95th Canadian Chemistry Conference and Exhibition

Tuesday PM

EF1Macleod D

Energy Futures Symposium

Organizer(s) - C. Berlinguette, W. Piers
Chair(s) - C. Berlinguette

13:40 01329 Transforming Canada's Energy System: Challenges and Opportunities Layzell D.B.
14:00 01330 Polytellurophenes to Bridge the Gap between Organic and Inorganic Semiconductors Jahnke A.A., Lee Y., Seferos D.S.
14:20 01331 Selective C-C and C-O Bond Cleavage in Lignin Models: First Steps to Obtaining Valuable Aromatic Chemicals from Lignocellulose Diaz-Urrutia C., Sedai B., *Baker R.T.
14:40 01332 Detection of Phase Heterogeneity in Complex Model Nuclear Waste Glasses Using Solid-State NMR Greer B.J., Levin K., Gaudin C., Schuller S., Kroeker S.
15:00 01333 Ordered Porous Nanostructured Thin Films of Platinum for Oxygen Reduction Reaction Electrocatalysis Kinkead B., VanDrunen J., Paul M.T.Y., Dowling K., Nazemi A., Jerkiewicz G., *Gates B.D.
15:20 Break

15:40 01334 Ultrafast Energy Transfer Dynamics in Light-Harvesting Proteins Lessons from Nature Dinshaw R., Scholes G.D.
16:00 01335 Chiral Mesoporous Carbon Derived from Nanocrystalline Cellulose Shopsowitz K.E., Law S., Hamad W.Y., MacLachlan M.J.
16:20 01336 Low Coordinate, Homoleptic Clusters of Cobalt and Nickel. A High Reactivity Base Metal Catalysts for Hydrodesulfurization and C-O Bond Hydrogenolysis Camacho-Bunquin J., Ferguson M., *Stryker J.M.
16:40 Coffee Break
17:00 Plenary Lecture - T.J. Meyer, Exhibition Hall E

PL1Exhibition Hall E

Plenary Lecture

17:00 01337 Finding the Way to Solar Fuels Meyer T.J.
18:00 End of Session

AN2TELUS 108,109

Electrochemistry with Chemically Modified Surfaces and Non-traditional Techniques (joint with PT)

Organizer(s) - Z. Ding, D Bizzotto, I. Burgess
Chair(s) - D. Bizzotto, J. Shepherd

13:40 01338 Spectroelectrochemical Studies of Self-assembled Nanotublar J-aggregates for Light Harvesting and Energy Transfer Stevenson K.J., Walker E.K., Vanden Bout D.A.
14:20 01339 Capacitance Behaviour of Ionic Liquids at Electrified Interfaces Gore T.R., $Burgess I.J.

Keith Laidler Award lecture:

14:40 01340 Electrochemical and Photochemical Catalysis Based on Functional Nanomaterials *$Chen A.
15:20 01341 Selective Determination of Ascorbic Acid with a Novel Hybrid Material Based 1-butyl-3-methylimidazolium Tetrafluoroborate Ionic Liquid and the Dawson Type Ion [P2Mo18O62]6- Immobilized on Glassy Carbon *$Ammam M., Easton E.B.
15:40 Break

16:00 01342 Bismuth Electrodeposition on Ultrathin Gold Substrates for Sensor Applications Saini M., Wang W., Chien C.L., *$Morin S.
16:20 01343 The Role of Gas Evolution during Pattern Formation via Electropolishing *$Kruse P., Pauric A.D.
16:40 Coffee Break
17:00 End of Session


Bioanalytical Mass Spectrometry (joint with BM)

Organizer(s) - D. Schriemer, L. Li
Chair(s) - L. Li

13:40 01344 Non-target Metabolomics and Proteomics to Decipher Gene/QTL Functions *$Kushalappa A.C., Raghavendra G.
14:00 01345 From Analytical Development to Water Safety: Novel Disinfection Byproducts $Li X.-F., Wang W., Zhao Y., Boyd J.M.
14:20 01346 Small Molecules: Pesticides and their Degradation Products *Raina R., Sun L., Hall P., Etter M.L., Smith E., Fergus N.
14:40 01347 Rapid Analysis of the Human Plasma Lipidome in a High Resolution Acquisition Workflow Simons B., Kauhanen D., Sylvanne T., Tarasov K., Duchoslav E., Ekroos K.
15:00 01348 Analysis of Anatoxins Based on Chemical Derivatization and Liquid Chromatography with Fluorescence and Mass Spectrometry Detection *Hollingdale C.R., Tremblay M.L., White R.L., $Quilliam M.A
15:20 01349 Analysis of Derivatized and Conjugated Phytosterols by MALDI-TOF/TOF and ESI-trapMS/MS *$Hailat I., Helleur R., Parrish C.
15:40 End of Session



Organizer(s) - M. McDermott, J.F. Masson
Chair(s) - A. Brolo

13:40 01350 Computer-readable bioDiscs for Medical Diagnosis Yu H.-Z.
14:20 01351 Discrimination of Complex Histone Code Type Analytes using Supramolecular Hosts Minaker S.A., $Hof F.
14:40 01352 Surface Plasmon Resonance Biosensors Based on Ionic Liquid Self-assembled Monolayer Ratel M., Schmitzer A., *Masson J.-F.
15:00 01353 Smart Surfaces to Study Dynamic Cell Behaviour Yousaf M.N.
15:20 01354 Array Biosensing Platform for the Detection of Cyanobacteria Toxins Using DNA Aptamers *Ng A., Chinnappan R., Tlili C., Liu H., $Zourob M.
15:40 Break

16:00 01355 Disposable Immunochips for Bacteria Detection using Electrochemical Impedance Spectroscopy Li N., Brahmendra A., Terebiznik M., *$Kerman K.
16:20 01356 SERS for Intracellular Imaging of Fungi Farazkhorasani F., Prusinkiewicz M.A., Kaminskyj S.G.W., $Gough K.M.
16:40 Coffee Break
17:00 End of Session

AN-PoExhibition Hall CD

Poster Session

From 18:00 until 19:30

18:00 01357 Influence of Oxychlorides on the Leaching of Zinc-Ore Concentrates Kariuki S., Sigouin B.
18:00 01358 Properties Affecting the Separation of Historically Important Dyes using Capillary Electrophoresis $Goltz D.M., *Ahmadi S., Craig D.B.
18:00 01359 Characterization of Micro Structured Fibre Channel Tolerances for Open Tubular Liquid Chromatography Using Plug Broadening Smith J., Cossette K., *$Oleschuk R.D.
18:00 01360 Phosphine-Catalyzed Conjugate Additions of Alcohols to Alkynic Acid Esters: A Mechanistic Investigation by NMR and ESI-MS Stoddard R.L., van der Wal N., *Wulff J.E., $McIndoe J.S.
18:00 01361 Dependence of Surface Enhanced Raman Scattering of Gold Nanorods on Aspect Ratio Elbayomy S.A., *McDermott M.T.
18:00 01362 Chemical Sensing Through Optical Refractometry and Refractive Index Changes within Functionalized Micro-Optical Devices Saunders J.E., Chen W.J., Barnes J.A., Yam S., *$Loock H.-P., Xu D.-X., Densmore A., Ma R., Janz S.
18:00 01363 Non-destructive Analysis of Metals in Feather Samples by Instumental Neutron Activation Analysis (INAA) $Haskins S.D., *Kelly D.G., Weir R.D., White S.D., Mattson K., Nielsen K.S.

AN1 - Analytical Separations posters

18:00 01364 Preconcentration and Speciation of Chromium Using Ionic Liquid Cold-induced Aggregation Dispersive Liquid-Liquid Microextraction *$Talei Bavil Olyai M.R., Zeeb M., Shaldozi Nobari S.
18:00 01365 On-chip Enrichment and Analysis of Peptide Subsets and Enzymatic Activity Assay Using Maleimide-functionalized Fluorous Affinity Biochip And NIMS Li J., $Lipson R.H.
18:00 01366 The Complex Chromatographic Behaviour of an Acid-Stable Hypercrosslinked Stationary Phase Nedev G.N., *Lucy C.A.
18:00 01367 Characterizing Sulfur Response in the Multiple Micro Flame Photometric Detector Clark A.G., $Thurbide K.B.
18:00 01368 Characterizing the Stability of Water as a Stationary Phase Gallant J., $Thurbide K.
18:00 01369 Accurate Determination of Phase Ratio and Column Dimensions in Gas Chromatography via Thermodynamic Modeling McGinitie T.M., Witty J., *$Harynuk J.J.
18:00 01370 Application of Chemometric Tools to the Discovery of Ignitable Liquids in Arson Debris Sinkov N., Sandercock P.M.L., *$Harynuk J.J.
18:00 01371 A Versatile Semi-permanent Coating for Capillary Isoelectric Focusing Bahnasy M.F., *$Lucy C.A.
18:00 01372 The Effect of Order and Disorder in Nanoporous Media on DNA Zone Electrophoresis on Chip Ye W., *Harrison J.D.
18:00 01373 Development of Molecularly Imprinted Polymers in Thin-Film Format for Rapid Detection of Phenols Gryshchenko A.O., Bottaro C.S., Robinson A., Brosseau C.L.
18:00 01374 Determination of the Constituents of Human Body Odour by SPME and GC×GC-TOFMS Ng S., *de la mata P., McQueen R., $Harynuk J.
18:00 01375 Sensitive Determination of 4-Methylimidazole in Food Products by Electrospray Ionization-Liquid Chromatography-Mass Spectrometry (ESI-LC/MS) Egorova Y., *$Donkor K.K.

AN2 - Electochemistry with Chemically Modified Surfaces and Non-traditional Techniques posters

18:00 01376 The Effects of Additives on the Electrochemistry and Morphology of Cu Electrodeposited on Au-mica Film Electrodes Han J., McCague C., *$Leach G.W.
18:00 01377 In-Situ Characterization of Peptide Self-assembled Monolayer with Electrochemical Methods Coupled with Fluorescence Imaging Yu Z.L., *$Bizzotto D., Maran F.
18:00 01378 Electrochemical Stimulation of PC12 Cells Li M.S.M., $Burgess I.J.
18:00 01379 Pd-based Nanocomposites for Hydrogen Storage Ostrom C.K., *$Chen A.

AN4 - Bioanalytical Mass Spectrometry posters

18:00 01380 Fused-Droplet Electrospray Ionization From Salt-Rich and Aprotic Solutions Blagojevic V., Koyanagi G.K., $Bohme D.K.
18:00 01381 Quantitative Proteome Resolubilization with Formic Acid for Top-down and Bottom-up MS Analysis Vieira D.B., Doucette A.
18:00 01382 Kinetic Capillary Electrophoresis Coupled with Mass Spectrometry (KCE-MS) Reveals Kinetics of Conformational Changes in G-Quadruplex DNA $Mironov G., Khan N., Okhonin V., *Berezovski M.
18:00 01383 HPLC-MS/MS Method to Quantitate Cyclobutane Thymine Dimer in a UV Exposed Reconstructed Human Skin Model Maini S., Fahlman B.M., *$Krol E.S.
18:00 01384 Optimization of Novel On-Column Methylation Chemistry to Facilitate Quantitative Analysis Using Tandem Mass Spectrometry Wasslen K.V., Manthorpe J., *$Smith J.C.
18:00 01385 Proteome Purification: The Effect of the Combination of Salt and Acetone on Recovery from Solvent Precipitation Crowell A., $Doucette A.
18:00 01386 The Direct, On-Line Monitoring of Trace Pharmaceuticals, Contaminants and Biomolecules in Complex Sample Matrices by Condensed Phase Membrane Introduction Mass Spectrometry (CP-MIMS) Yamamoto M., Duncan K.D., Willis M.D., Krogh E.T., Gill C.G.

AN7 - Biosensors posters

18:00 01387 Development of Single Fluorescent Protein Based Biosensors Based on Repeated Beta Strand Strategy Saini R., *$Campbell R.E.
18:00 01388 DNA Amplification and Chip-based Detection using Replication by Destabilization under Isothermal Conditions Li Y., *Kausar A., Mitran C., $Gibbs-Davis J.M.
18:00 01389 Novel Cellulose Nanocrystal Probe for Imaging of Apoptotic Cell Simao T., *$Zourob M., Ng A., Mahmoud K.
18:00 01390 Development of Digital ELISA for Single Molecule Detection of Breast Cancer Biomarkers Vu T.L., Geldart-Flashman J., Walt D.R.
18:00 01391 Chimaeric RNA-DNA Molecular Beacons for Quantification of UV-Induced Nucleic Acid Damage *El-Yazbi A.F., $Loppnow G.R.
18:00 01392 2-Aminopurine Hairpin Probes for the Quantification of Nucleic Acid Damage Induced by UV-light *El-Yazbi A.F., $Loppnow G.R.
18:00 01393 Probing UV-Induced Damage in Nucleic Acids with Hypochromism *El-Yazbi A.F., $Loppnow G.R.
18:00 01394 Studying Heterogeneity of Switching DNA Self Assembled Monolayers Casanova-Moreno J.R., *$Bizzotto D.
18:00 01395 Concurrent Monitoring of Multiple Cell Processes with Fluorescent Protein Biosensors Ding Y., Ai H., Alford S., *$Campbell R.
18:00 01396 Filter Paper Blot Screening For Fluorescent Protein Based Sensor Development Shen Y., *$Campbell R.E.
18:00 01397 Diazonium Derived Aryl Films and Mixed Mode Bonded Layers on Gold for Surface Plasmon Resonance Biosensing Toman J.T., McDermott M.T.
18:00 01398 Graphene-based Label-free Electrochemical Immunosensor for the Sensitive Detection of Food Allergens Eissa S., Tlili C., *Zourob M.
18:00 01399 Optimization of a Fluorogenic DNAzyme Based Assay for E. coli Detection Aguirre S.D., Ali M.M., *$Li Y.
18:00 01400 Label-free Multiplexed Impedimetric Immunosensor for Ultrasensitive Detection of Brain Tumor Biomarkers Elshafey R., Ng A., Tlili C., Abulrob A., Tavares A., *Zourob M.
18:00 01401 Quartz Crystal Microbalance Immobilized Poly (N-Isopropylacrylamide) Microgel-Based Etalons for Glucose *Jones I., $Serpe M.
18:00 01683 Multi-model DNA Biosensor Based on Fluorescence Resonance Energy Transfer Between Lanthanide Doped Hybrid Core-Shell PSA Beads and Gold Nanoparticles Jesu Raj J.G., Mehmood K., Ng A., Vetrone F., *$Zourob M.

ANMacleod A4

Advances in Environmental Analytical Chemistry (joint with EN1)

13:40 See EN1.

17:00 End of Session


Biophysical Chemistry (joint with PT)

Organizer(s) - M. Khajepoor, E. Prenner
Chair(s) - P. Pawelek, M. Khajehpour

13:40 01402 Structural Insights into the Unique Phototransduction Cascade of Anabaena Sensory Rhodopsin Wang S., Shi L., Kawamura I., Kim S.Y., Jung K.H., Ladizhansky V., Brown L.S.
14:20 01403 Phenylalanine Ammonia Lyase Activity in Non-aqueous Media *$D'Cunha G.B.
14:40 01404 Structural and Dynamic Insights into the Function and Fidelity of Poliovirus Polymerase Using NMR *$Boehr D.D., Yang X., Welch J.L., Lum D., Liu X.
15:00 01405 Real-Time Monitoring of Tissue Transglutaminase Conformation Using Kinetic Capillary Electrophoresis Clouthier C.M., Mironov G., Okhonin V., Berezovski M.V., $Keillor J.W. WITHDRAWN
15:20 01406 Engineering Motion into a Rigid Protein: Insights into Bacterial Resistance Clouthier C.M., Gobeil S., Park J., Berghuis A., *$Pelletier J.N.
15:40 Break

16:00 01407 Molecular Mechanisms of Enzyme Allostery Studied by NMR and Calorimetry Freiburger L., Zhu S., Auclair K., *$Mittermaier A.
16:40 Coffee Break
17:00 End of Session


Bioanalytical Mass Spectrometry (joint with AN4)

13:40 See AN4.

15:40 End of Session

BMMacleod E2

Metal Ions in Biology (joint with IN7)

13:40 See IN7.

16:40 End of Session


Multiscale Bio/Physical/Chemical Modelling

13:40 See PT3.

16:40 End of Session


Teaching Introductory Chemistry

Organizer(s) - V. Mozol
Chair(s) - C. MacConnachie, V. Mozol

13:40 01408 Experiential Approach to First Year Chemical Kinetics Lefebvre J., Kusalik P.G.
14:00 01409 Updating the First Year Chemistry Lab Experience Lippa W.K.
14:20 01410 The Importance of IUPAC Conventions when Teaching Thermochemistry/Thermodynamics in First Year Chemistry! Fridgen T.D.
14:40 01411 ICE, ICE, Baby: LeChatelier meets Equilibrium Problems Jansen M.P.
15:00 01412 Exploring and Teaching Concision in Scientific Writing *$Hudson R.
15:20 Break

15:40 Panel Discussion

16:40 Coffee Break
17:00 End of Session

EN1Macleod A4

Advances in Environmental Analytical Chemistry (joint with AN)

Organizer(s) - C. Bottaro, R. Raina
Chair(s) - C. Bottaro, R. Raina

13:40 01413 Low Tech Approach to Microfluidic Devices that Integrate Molecularly Imprinted Polymers (MIPs)- Phase 1 *$Egli S.N., Bottaro C.S.
14:00 01414 Porous Polymer Monolith: Versatile, Tailorable, Robust Materials of Wide Applicability *$Mugo S.M.
14:20 01415 Use of Flexible Linear Tricationic Ion Pairing Reagents in Analysis of Sulfur oxyanions by Capillary Electrophoresis ESI-MS *Bottaro C.S., $Pappoe M.
14:40 01416 Development of UPLC-ESI-MS/MS Method for Fast Determination of 12 Halo-benzoquinones in Water Huang R.-F., Wang W., Zhao Y., *$Li X.-F.
15:00 01417 Quantification of Simvastatin and Simvastatin Acid in the Blood and Lavage of Mice Treated for Respiratory Inflammation and Hyperreactivity Bews H.J., Carlson J.C., Jha A., Basu S., Halayko A.J., *Wong C.S.
15:20 01418 Feasibility of Compound Specific Carbon Isotope Analysis for Indoor Air and Soil Gas VOCs in Stainless Steel SUMMA-Passivated Air Canisters Morin M.D., Lacrampe-Couloume G., *$Sherwood Lollar B.
15:40 01419 N2 Fixation Estimates in Real-Time by Acetylene Reduction Assays by Cavity Ring Down Laser Absorption Spectroscopy (ARACAS) *$Bellenger J.P., Cassar N., Jean M.E., Barnett B., Setzer C.
16:00 01420 Improved Detection Instrument for Nitrogen Oxide Species (iDINOS) Odame-Ankrah C.A., *Osthoff H.D.
16:40 Coffee Break
17:00 End of Session

EN2Macleod A2,3

Fire and Ice: Atmospheric Chemistry from Biomass Burning to Ice Aerosols (joint with PT)

Organizer(s) - A. Bertram, H.D. Osthoff
Chair(s) - J.R. Pierce, H.A. Al-Abadleh

13:40 01421 Using Singlet Molecular Oxygen to Probe Composition and Chemistry in Liquid-Like Regions of Ice *$Anastasio C., Bower J.
14:20 01422 Hydroxyl Radicals in Ice: Its Implication to Atmospheric Reaction Codorniu-Hernández E., *$Kusalik P.G.
15:00 01423 Skating on Thin Ice: Laser Probing of Chemistry at the Air-Ice Interface *$Donaldson D.J.
15:40 01424 On the Photochemistry of Nitrate in Ice Abida O., *Osthoff H.D.
16:00 01425 Ionization and Enhanced Photochemistry of Nitric Acid on Ice Marcotte G., *$Ayotte P., Pronovost S., Marchand P., Laffon C., Parent Ph.
16:40 Coffee Break
17:00 End of Session

EN-PoExhibition Hall CD

Poster Session

From 18:00 until 19:30

EN5- Current Topics in Environmental Chemistry Posters

18:00 01426 Elimination of Chlorine Taste and Odor from Drinking Water by Ascorbic Acid and Ultraviolet Light Qian Y., Wang W., Huang R., Hrudey S.E., *Li X.F.
18:00 01427 Photodechlorination Kinetics of Trace Contaminants in Natural Waters Using Membrane Introduction Mass Spectrometry as an In-Situ Reaction Monitor Letourneau D., Gill C.G., *Krogh E.T.

EN1 - Advances in Environmental Analytical Chemistry posters

18:00 01428 Adsorption Study of Metal Ions on Electrochemically Synthesized Poly-(ortho-phenylenediamine) *$Etorki A., El Rais M., Abuein M.
18:00 01429 Method Development for Enhanced Analysis of Anions in Oilfield Waters by Capillary Electrophoresis *$Donkor K.K., Campbell M., Jaswal N., Risley J.M., Schmidt K.
18:00 01430 Stereo-specific Bioaccumulation of Chiral PCBs in a Marine Food Web from Cumberland Sound, Nunavut, Canada Lu Z., *Wong C.S., Silva G.S., Tomy G.T., Rosenburg B., Leblanc B., McMeans B.C., Fisk A.T., Morris A., Marvin C.H., Muir D.C.G.
18:00 01431 A New Method of Detecting Total Viable Organisms in Water Based on Solid-phase Microextraction and Fluorescent Signal Detection Zhang M., Dunkinson C., Marcotte E., Bowers R., *$Brown S.R.
18:00 01432 Sustainable Energy Generation from Municipal Waste Plastics *Sarker M.
18:00 01433 Towards Determination of Acidic Trace Gases by Mist Chamber Extraction Coupled to Capillary Electrophoresis - UV/Vis Detection Zhou X., *Osthoff H.D.
18:00 01434 Spectroelectrochemical Studies of Adsorbed Arsenate on Ferrihydrite Sigrist J.A., Burgess I.J.
18:00 01435 Short-term Kinetics of Dinitrogen Fixation: Applications of a Novel Technique, ARACAS Jean M.-E., Cassar N., *Bellenger J.-P., Setzer C., Barnett B.
18:00 01436 Measurement and Occurrence of PFCs in Indoor Air and Dust and their Potential Impact on Respiratory Problems in Young Children Nikoobakht N., McConkey C., Low J., Bows H., Sieffert C., Gunson D., $Wong C., Loewen M., Becker A.
18:00 01437 Perfluorinated Compounds in Blood and their Potential Impact on Respiratory Problems in Young Children in Winnipeg, Manitoba McConkey C., Low J., Bews H., Loewen M., Becker A., $Wong C.
18:00 01438 Development of Porous Polymer Microextraction (PPME) Devices for Online-GC MS Analysis Huybregts L., Mugo S., Ayton K.
18:00 01439 Extraction and Quantification of Six Pharmaceutical Contaminants in Plant and Sediment Matrices Elliott A.D., Carlson J.C., Challis J.K., Cardinal P., Low J.E., Hanson M.L., *$Wong C.S.

EN2 - Fire and Ice: Atmospheric Chemistry posters

18:00 01440 Multiphase and Photosensitized Chemical Kinetics of Biomass Burning Surrogate Compounds with Typical Atmospheric Oxidants and Radicals *$Knopf D.A., Forrester S.M., Slade J.H., Shiraiwa M., Poschl U.
18:00 01441 Identification and Aging of Secondary Organic Aerosol Formed from the Photo-oxidation of b-pinene Sarrafzadeh M., Hastie D.
18:00 01442 Effects of Organic Coatings on the Transfer of Photochemically Active Species Across the Air--Aqueous Interface Reeser D.I., $Donaldson D.J.
18:00 01443 Illuminating Urban Grime Baergen A., $Donaldson D.J.

EN3 - Chemistry of Oil Sands Reclamation and Monitoring

18:00 01444 Investigating Environmental Fate of Process Chemicals and Naphthenic Acids *Wang X., Robinson L., $Kasperski K.
18:00 01445 Analysis of Oil Sands Process-Affected Water Constituents by Comprehensive Two-Dimensional Liquid Chromatography (LCxLC) Ross M.S., Wang Y., Rowland S.J., *$Martin J.W.
18:00 01446 Sorption of Naphthenic Acids using Chitosan Copolymers Poon L., *$Wilson L.D., Headley J.V., Peru K.M.

IC2Macleod A1

Innovation in Industrial Chemistry and Technology

Organizer(s) - L. May
Chair(s) - M. Hopkins

13:40 01447 Characterization of Intermediate Species in the Preparation of MoS2 Nanocatalysts from Ammonium Tetrathiomolibdate (ATTM) *Molero H., Scott C., Pereira_Almao P.
14:00 01448 Highly Promising Ni/H-ZSM-5 Catalysts for use in Hydrocracking Processes *Aquino S., Vitale G., Hernandez E., Molero H., Pereira P., $Birss V.
14:20 01449 Sulfur-assisted Oxidative Dehydrogenation of C3-C4 Alkanes for the Production of Propylene Premji Z., Clark P.D.
14:40 01450 Connecting Your Technology to the Right Market Opportunity Leger L.
15:20 End of Session

ICGlen 203

Gas Capture Materials (joint with MT1)

13:20 See MT1.

16:40 End of Session

IN5Macleod E3

Main Group Chemistry

Organizer(s) - E. Rivard
Chair(s) - P. Ragogna

13:20 01451 The Synthesis and Reactivity of Metallocene-Substituted a-diimine Ligands Magdzinski E., Ragogna P.J.
13:40 01452 Stable Neutral Tricoordinate Organoboron Derivatives Isoelectronic with Amines Bertrand G.
14:20 01453 Merging the Chemistry of Electron-Rich Olefins (ERO) with Imidazolium Ionic Liquids Sherren C.N., Mu C., Webb M.I., McKenzie I., McCollum B.M., Brodovitch J.-C., Percival P.W., Storr T., Seddon K.R., *Clyburne J.A.C., Walsby C.J.
14:40 01454 Oxophilic Heterocyclic Phosphenium Cations Hendsbee A.D., Giffin N.A., *$Masuda J.D.
15:00 01455 Asymmetric Dicoordinate Phosphorus(III) Cations: Synthesis and Reactivity with Hydrogen Gray P.A., Koncovy V.J., *Ellis B.D.
15:20 01456 Tetraelphosphonium Salts $MacDonald E.P., *Burford N., Werner-Zwanziger U., Decken A.
15:40 Break

16:00 01457 Disilenes and Digermenes as Molecular Models for the Reactivity of Dimers on Si- and Ge(100)-2x1 Surfaces *$Baines K.M.
16:40 Coffee Break
17:00 End of Session

IN7Macleod E2

Metal Ions in Biology (joint with BM)

Organizer(s) - F. Jalilehvand, J. Gailer
Chair(s) - D. Zamble, T. Storr

13:40 01458 New Adventures in Phosphorylation Chemistry Kraatz H.-B.
14:00 01459 Genetic Material Interaction and Cleavage Using Copper Complexes: An Underpinning Step to Breast Anti-Proliferative Study Subramani R., *Balachandran U.N.
14:20 01460 Evaluation of the Interaction of Metal Ions (Pt, Ru, Re, Tc, Zn, Cd, Cu, Pb) with Proteins and DNA by ESI-TOF MS *Palacios Ò., Atrian S., $Capdevila M.
14:40 01461 Reaction Pathways of Ru(III) Anticancer Prodrugs *$Walsby C.J., Al-Jobory Y.M., Mu C., Webb M.I.
15:00 01462 Evaluating the Role of Ru-S Bonding in Defining the Biological Mechanism of Ru Arene Anticancer Agents Sriskandakumar T., Petzold H., Bruijnincx P.C. A, Habtemariam A., Sadler P.J., *$Kennepohl P.
15:20 01463 Rh(II) Acetate Complexes with Thiol Containing Ligands *$Jalilehvand F., Niksirat P.
15:40 Break

16:00 01464 Methylmercury and Sensory Organs: Linking Uptake with Functional Deficits in Developing Vertebrates Korbas M., MacDonald T.C., Sylvain N.J., Pickering I.J., George G.N., Krone P.H.
16:20 01465 Interactions of Cadmium with Iron and Zinc in Freshwater Fish: Uptake and Metabolism *Niyogi S., Kwong R.
16:40 Coffee Break
17:00 End of Session

INGlen 201

Solid State Chemistry (joint with MT4)

13:40 See MT4.

16:40 End of Session

MS-PoExhibition Hall CD

Poster Session

From 18:00 until 19:30

MS1 - Polymers for Fuel Cells and Batteries posters

18:00 01466 Chitosan Membrane for Fuel Cells and Batteries Li S., *Yu Y.
18:00 01467 Performance Comparison of Long and Short-Side Chain Perfluorosulfonic Acid Membranes for PEM Fuel Cells Zhao N., Edwards D., Holdcroft S., *Shi Z.

MS2 - Chemistry and Applications of Carbon Nanotubes, Graphene and Other Nanostructures posters

18:00 01468 Fabrication and Optical Properties of Dye Labeled SERS-Encoded Au/Ag Alloy Nanoshells Shen W.-Z., Parthasarathy V., Cho J.-Y., *$Fenniri H.
18:00 01469 Reversible Dispersion and Releasing of Single-walled Carbon Nanotubes by a Stimuli-responsive TTFV-Phenylacetylene Polymer Liang S., Chen G., Peddle J., *Zhao Y.
18:00 01470 Local Structure of Titania Decorated Double-walled Carbon Nanotube Characterized by Scanning Transmission X-Ray Microscopy Zhang H., Wang J., Chen X., Hu Y., *Pan X., Bao X.
18:00 01471 Microscopic Investigation of Nano-Composite made by the Mixture of Carbon Nanotube and Rosette Nanotube *Cho J.-Y., $Fenniri H., Duque J.G., Doorn S., Green M.
18:00 01472 Chemical and Structural Variation of Co3O4 Nanocrystals Grown on Nitrogen-doped Graphene *$Wang J., Zhou J., Liang Y., Li Y., Wang H., Regier T., Hu Y., Dai H.
18:00 01473 Polystyrene/Nanocrystalline Cellulose Nanocomposites El Bakkari M., Danumah C., *$Fenniri H.
18:00 01474 New Strategy for Making Polystyrene/Nanocrystalline Cellulose Composites Danumah C., *$Fenniri H.
18:00 01475 New Strategy for Making Polystyrene/Nanocrystalline Cellulose Composites Danumah C., *$Fenniri H.
18:00 01476 Synthesis and Characterization of Cu2ZnSnS4 (CZTS) Nanostructures for Solar Cell Application Lee L.Y.S., Ha E., Wong K.Y.
18:00 01477 Evaluation of the Accessible Inclusion Sites in Copolymer Materials containing b-Cyclodextrin *$Wilson L.D., Mohamed M.H., Headley J.V.
18:00 01478 Encapsulation of Silicon Nanocrystals into a Mesoporous Carbon Shell Hadidi L., Gonzalez C.M., *$Veinot J.G.C.
18:00 01479 p-Conjugated Polymers with Pendant Coumarins: Design, Synthesis, Characterization and Interactions with Carbon Nanotubes Imit M., Imin P., *$Adronov A.
18:00 01480 Electrospinning of Green Carbon Fibre Precursors from Lignin Schreiber M., Vivekanandhan S., $Mohanty A., *Misra M.

MS3 - Responsive Polymer Materials posters

18:00 01481 Development of Azo-Functionalized Sol-Gel Thin Films for Self-Cleaning Surfaces Singleton T.A., Beaulieu-Houle G., *$Barrett C.J.
18:00 01482 Photoswitchable Polyelectrolyte Multilayers: Towards Directed Cell Growth Goulet-Hanssens A., *$Barrett C.J., Wai Ling Sun K., Kennedy T.E.
18:00 01483 Structural Characterization of a Urethane-Based "Molecular Accordion" Copolymer in Aqueous Solution. *Wilson L.D., Karoyo A.H.

MS4 - Modern Methods in Polymer Synthesis posters

18:00 01484 Cyclodextrin-based Biodegradable Polymer Stars: Synthesis, Degradation and Fluorescence Studies Tennekone G.K., Wagner B.D., *Shaver M.P.
18:00 01485 Nucleobase-templated Polymerization: From DNA to Synthetic Polymers Barlog M., Nayak M.K., de Castro I.B.D., Bazzi H.S., *$Sleiman H.F.

MS5 - Polymeric Nanotechnology: Applications in Biomedical Imaging and Drug Delivery posters

18:00 01486 Binding and Trafficking of Opioid Receptors in Living Cells Ma Q., *Cramb D.T.
18:00 01487 Engineering Peptide-Nanoconjugates for Breast Cancer Targeting *Ahmed S., Stella Mathews A., Lavasanifar A., $Kaur K.
18:00 01488 Biodegradable Poly(ester amide) Nanoparticles Covalently Attached to Floxuridine: Synthesis, Characterization and Release Kinetics Moustafa M.M. Abd, Zilinskas G.J., *$Gillies E.R.
18:00 01489 Dendrimer-based Imaging Agents Mackey V., *Adronov A., Valliant J., Sadowski L.
18:00 01490 Shear-Directed Block Copolymer Self-Assembly into Vesicles on a Microfluidic Chip Bains A., $Wang C.-W., *Moffitt M.G., Sinton D.
18:00 01491 Dual Thiol- and pH-Responsive Biodegradable Cationic Sheddable Micelles for Dual Drug and Gene Delivery Ko N.R., $Oh J.K.
18:00 01492 Development of Nanoscale Aptamer Films for Controlled Release of Encapsulated Payloads Foster A.G., Sultan Y., Monreal C., $DeRosa M.C.
18:00 01493 Bioconjugation: Covalent Immobilization on Silane Monolayer for Microfluidics Applications Singh M., Gunda N., Kaur K., *Mitra S.
18:00 01494 Mono-cleavable Triblock Copolymer Micelles Labeled with Single Disulfide Linkages: Change in Morphology upon Thiol-responsive Degradation Khorsand Sourkohi B., *Oh J.K.
18:00 01495 siRNA Delivery Studies in Chronic Myeloid Leukemia Cells with Lipid-Modified Polymers Valencia Serna J., Hsu C., Landry B., *$Uludag H., Jiang X.

MS6 - Computational Methods and Studies in Polymers and Materials by Non-Computational Chemists posters

18:00 01496 A New Algorithm for Counting Defects in Block Copolymer Thin Films *Murphy J.N., Harris K.D., $Buriak J.M.

MS7 - Block Copolymer Fundamentals and Applications

18:00 01497 Quantum-dot/Polymer/Gold Nanoparticle Assemblies Ribeiro T., Prazeres T., *Moffitt M., Farinha J.P.S.
18:00 01498 Coil-rod-coil Triblock Copolymer and Its Photovoltaic Property Zhang C., *$Holdcroft S.

MT1Glen 203

Gas Capture Materials (joint with IC)

Organizer(s) - G. Shimizu
Chair(s) - G. Shimizu, T. Woo

13:20 01499 Post Combustion Carbon Capture: Materials and Processes Challenges *$Favre E., Roizard D.
14:00 01500 Amine-modified Nanoporous Materials for CO2 Adsorption Sayari A.
14:40 01501 Carbon Dioxide Capture in Metal-Organic Frameworks McDonald T.M., Bloch E.D., Herm Z.R., Sumida K., Mason J.A., *Long J.R.
15:20 Break

15:40 01502 Gas Adsorption Evaluation of Activated Carbon Materials Using Combinatorial Methods Romero J.V., Smith J.W.H, Sullivan B.M., Andress C., Simon M., Croll L.M., *$Dahn J.R.
16:00 01503 Molecular Design and Assessment of Metal-Organic Frameworks for CO2 Capture Wilmer C.E., Bae Y.-S., Sikora B.J., *$Snurr R.Q.
16:40 Coffee Break
17:00 End of Session

MT4Glen 201

Solid State Chemistry (joint with IN)

Organizer(s) - V. Thangadurai, A. Grosvenor
Chair(s) - A. Grosvenor

13:40 01504 Discovery Solid State Chemistry: Synergy between Serendipity and Rational Design *Subramanian M.
14:20 01505 Preparation of Single Crystals of Covalent Organic Frameworks Beaudoin D., Maris T., $Wuest J.D.
14:40 01506 "Accelerated Aging": A Novel, Solvent- and Energy-Efficient Method for the Synthesis of Zeolitic Imidazolate Frameworks Mottillo C., Stein R.S., Cliffe M.J., $Friscic T.
15:00 01507 Quaternary Arsenides Stoyko S.S., Khatun M., Ramachandran K.K., Mullen C.S., *Mar A.
15:20 01508 Gd5(Ga,Sb)4: A Sm5Ge4 System Beyond Tetrelides *Yao J., $Mozharivskyj Y.
15:40 Break

16:00 01509 Much Ado About Nothing:Oxygen Vacancy Order and Disorder in Defect Perovskites: Local and Long Range Structure and Magnetism Greedan J.E., Ramezanipour F., Cranswick L.M.D., Donaberger R.L., Garlea V.O., Siewenie J., King G., Llobet A., Botton G.A., Turner S., Ryan D.H., Grosvenor A.P.
16:40 Coffee Break
17:00 End of Session

OR3Macleod C

Symposium in Honour of Edward Piers

Organizer(s) - V. Snieckus
Chair(s) - V. Snieckus

13:40 01510 New Samarium Diiodide Mediated Cascade Reactions to Heterocycles: A Short Route to Strychnine Reissig H.
14:20 01511 New Applications for Chlorohydrins in Natural Product Synthesis *$Britton R.A.
15:00 Break

15:20 01512 Function Oriented Synthesis of Marine Natural Product Pharmacophores Andersen R.J.
16:00 01513 Second Generation Hepatitis C Virus NS3 Protease Inhibitors with Improved Antiviral Profile Llinas-Brunet M.
16:20 End of Session

OR4Macleod B

Advances in Synthetic Methods

Organizer(s) - T. Back
Chair(s) - T. Back

13:40 01514 Approaches to Lysergic Acid Via Ammonium Ylide Rearrangement Dunbar C.R., $West F.G.
14:00 01515 Chemoenzymatic Approach to Diverse Analogues of Pancratistatin and Narciclasine Vshyvenko S., Scattolon J., *$Hudlicky T.
14:20 01516 Some Adventures in Synthesis: Natural Products and Methodology *Clive D.L.J.

Alfred Bader Award lecture:

15:00 01517 From Free-Radicals to Polypropionates Guindon Y.
15:40 Break

16:00 01518 Recent Advances in the Synthesis of Heterocycles from Cyclopropanes *$Kerr M.A.
16:40 Coffee Break
17:00 End of Session

PT1Glen 205

Theoretical Approach to Molecular Spectroscopy

Organizer(s) - T. Ziegler
Chair(s) - M. Krykunov, M. Nooijen

13:00 01519 Molecular Electronic Excitation in the Presence of a Plasmonic Environment *$Masiello D.J.
13:40 01520 Theories of Plasmon Enhanced Optical Processes *Schatz G.C.
14:20 01521 Spectroscopy, Structure, and Dynamics of Water: Ice, Liquid, Surface, Clusters Skinner J.L.
15:00 01522 Optical Properties and Organizational Principles of ONLO Based Materials *$Robinson B.H., Eichinger B.E., Tillack A.F., Johnson L.E.
15:40 Break

16:00 01523 Excited State Dynamics in Paradigm Biological Chromophores *$Sension R.J.
16:40 Coffee Break
17:00 End of Session


Multiscale Bio/Physical/Chemical Modelling

Organizer(s) - D. Salahub, P. Noskov, P. Tieleman
Chair(s) - M. Karttunen, G. Lamoureux

13:40 01524 Simulations of Chemical and Biological Systems From Explosives to Membrane Proteins *$Wei D.Q., Gu R.X., Lian P., Fan H.
14:20 01525 Quantum Molecular Dynamics: From Superfluid Droplets to Biomolecules *$Roy P.-N.
15:00 01526 Multiscale Computational Modeling of the Microstructure-Recalcitrance Relationship in Plant Cell Walls *Silveira R.L., Stoyanov S.R., Gusarov S., Skaf M.S., Kovalenko A.
15:20 01527 Nanocrystalline Cellulose Particles in Electrolyte Solutions: MD/3D-RISM Study Lyubimova O., Cuervo J.E., Stoyanov S.R., Kobryn A.E., Gusarov S., Blinov N., $Kovalenko A.
15:40 Break

16:00 01528 Interactions of Laulimalide, Peloruside, and their Derivatives with Ten Isoforms of b-tubulin Gajewski M., Klobukowski M., Barakat K., Huzil J.T., Tuszynski J.
16:40 Coffee Break
17:00 End of Session



Organizer(s) - Y. Shi
Chair(s) - J. Wang

13:40 01529 Asymmetric Activated Carbon-MnO2 Supercapacitors in Protic Ionic Liquids Castro Ruiz C.A., *Rochefort D., Bélanger D.
14:00 01530 Photoelectrochemical Oxidation Behavior of Hydroquinone in Acidic Media Hu X., Feng J., *Wang J.
14:20 01531 The Detection of Low Volatility Chemical Warfare Agents on Complex Surfaces using PMIRRAS *$Petryk M.W.P., Marenco A.J.
14:40 01532 The Effect of the Chain Alkyl Length on the Properties Ferrocenyl Imidadazolium Ionic Liquid Gélinas B., Forgie J., *$Rochefort D.
15:00 01533 Sulfur 1s Near Edge X-ray Absorption Fine Structure (NEXAFS) of Different Sulfur Functionalities $Behyan S., Hu Y., *Urquhart S.G.
15:20 01534 Transport Properties of a Redox-Active Ionic Liquid Through Electrochemical and Physiochemical Measurements Forgie J., Rochefort D.
15:40 01535 Reverse-docking of Sigman's Asymmetric Hetero-Diels-Alder Organocatalysts *$Deslongchamps G., Lambropoulos A.
16:00 End of Session

PT-PoExhibition Hall CD

Poster Session

18:00 01536 Inhibition of Influenza Neuraminidase: Steered Molecular Dynamics for Efficient Screening LeGresley E.B., Greenway K.T., *$Pinto B.M.
18:00 01537 Redox Reactions Between Bromide and Metal Ions and their Application in the Development of New Chemical Oscillators Li J., *Wang J.
18:00 01538 Theoretical Study of Alkyl + O2 and Alkyl + S2 Reactions Lo J.M.H., Premji Z., Clark P.D.
18:00 01539 Spectroscopy and Structure of Cyanoformyl Chloride and Cyanoformyl Bromide XC(O)CN, X = Cl, Br. Pasinszki T., Vass G., Klapstein D., Westwood N.P.C.
18:00 01540 Rheology Modification in Anionic/zwitterionic Surfactant Mixture by Non-aromatic Hydrotropic Salts: Monomeric and Dimeric inducers Singh K., O'Toole Z., McLachlan A.A., *Marangoni D.G.
18:00 01541 Are Extended Structures Based on C52- Viable? *$Sowlati Hashjin S., Matta C.F.
18:00 01542 Aromaticity of Planar Tetracoordinate Carbons; To Be or Not To Be? Sowlati Hashjin S., *$Foroutan-Nejad C.
18:00 01543 Atomic Origins of the Dipole and Polarizability Enhancement Near the Transition States of X + H-CH3 [ XH + CH3 (X=F, Cl) *Sowlati Hashjin S., Matta C.F., Bandrauk A.D.
18:00 01544 Solubilization and Location of Phenol and Benzene in a Nonlinear Amphiphilic EO-PO Block Copolymer Micelles: 1H NMR and SANS Studies Parekh P., Singh K., *Marangoni D.G., Aswal V.K., $Bahadur P.
18:00 01545 A Fragile-Strong Crossover in a Confined Hard Discs Fluid Zaeifi Yamchi M., Ashwin S.S., *Bowles R. K.
18:00 01546 Molecular Dynamics Simulations of Competitive Nucleation in Gold Nanoclusters Asuquo C.C., Bowles R.K.
18:00 01547 An Analysis of Supported and Unsupported Metal-Metal Bonds between Group 6D metals Based on the ETS -NOCV Scheme Ndambuki S., Ziegler T.
18:00 01548 DFT Investigation of the Mechanistic Flexibility of the Chemical Steps of a Glycosylase/b-lyase Enzyme (hOgg1) Kellie J.L., *Wetmore S.D.
18:00 01549 Structure Dependence in the Carbon 1s X-ray Absorption Spectra of n-alkanes $Perera S., Wang J., *Urquhart S.G.
18:00 01550 Computational Mechanism Study: Electrocatalytic Reduction of Carbon Dioxide by Aqueous 4-Methylpyridinium *Smith R.D.L., $Warburton P.L., Poirier R.A.
18:00 01551 Through-Bond and Through-Space Interactions in Small Aromatic Molecules Antal Z.
18:00 01552 Effect of Confinement on the Energy Barrier in Decomposition of HRgX Fitzsimmons A., *Klobukowski M.
18:00 01553 Examining Tubulin-Taxane Interactions with the Fragment Molecular Orbital Method Churchill C.D.M., Klobukowski M., Tuszynski J.A.
18:00 01554 Applying the Fragment Molecular Orbital Method to p-p Interactions Churchill C.D.M.
18:00 01555 Computer Simulations of the Melting of Model Ionic Crystals Lindenberg E.K., $Patey G.N.
18:00 01556 Chemometric Modeling of Catalyst Enantioselectivity by Molecular Orbital Descriptors Trefiak N.R., Fernandez M., *Woo T.K.
18:00 01557 Asymmetric Activated Carbon-MnO2 Supercapacitors in Protic Ionic Liquids Castro Ruiz C.A., *Rochefort D., Bélanger D.
18:00 01558 Partial Molar Volumes and Heat Capacities for Contact- and Solvent-Separated Ion Pairs of MgSO4 and NiSO4 under Hydrothermal Conditions Madekufamba M., *$Tremaine P.R.
18:00 01559 Potential Energy Surfaces at Extreme Conditions of Ultra-High Pressures Yanciw B., Spooner J., Weinberg N.
18:00 01560 MD-generated Volume Profiles for Study of the Transition State Structures for Chain Folding Wiebe H., Weinberg N.
18:00 01561 Theoretical Determination of Partition Coefficients of Linear Perfluorinated Acids Hidalgo A., *$Mora-Diez N.
18:00 01562 DNA Assisted Heterogeneous Integration of micro and nano-devices: Modeling, Control, and Rational Design of Selective Attachment *Yesudas J.P., Dew S.K., $Kovalenko A.
18:00 01563 Molecular Docking as a Tool for the Discovery of Small-molecule Probes for Key Targets in Cancer Research, EphB4 and Carbonic Anhydrase IX Kamstra R., Floriano W., Freywald A., Abraham S.

PT1 - Theoretical Approach to Molecular Spectroscopy posters

18:00 01564 Quantum-Classical Simulation of the IR Spectrum of the OD stretch in HOD/H2O Sun S., *$Hanna G.
18:00 01565 Simulation of Water Structure and Water Nonlinear Vibrational Spectra Next at Solid Surfaces Roy S., *$Hore D.K.
18:00 01566 Mixed Quantum-Classical Liouville Simulation of Nonlinear Optical Response in the Mapping Basis Using the Equation-of-Motion Phase-Matching Approach Rekik N., *$Hanna G.
18:00 01567 Solute-Solvent Interactions by Circular Dichroism Spectroscopy: Methyl Mandelate in DMSO and CDCl3 Poopari M.R., *$Xu Y.
18:00 01568 Chiral Diphosphine Compounds in Solution: Vibrational Circular Dichroism and Density Functional Theory Dezhahang Z., Merten C., Poopari M.R., *$Xu Y.
18:00 01569 Vibronic Simulations of Photodetachment Spectra of Small Biradical Systems Goel P., *$Nooijen M.
18:00 01570 The Solvated Electron in Alcohol Clusters: Structure and Dynamics Mak C.C., *Peslherbe G.H.
18:00 01571 The Routine Construction of Vibronic Models and their Application to Simulation of Photoelectron Spectra Endicott J., $Nooijen M.

PT2 - Fuel Cell Materials for Clean Energy Options posters

18:00 01572 Functionalized Carbon Nanotubes Based Composite Membranes for Polymer Electrolyte Fuel Cells Ramaiyan K., *Vijayamohanan P.
18:00 01573 Monitoring Degradation and Ethanol Oxidation Performance at Pt-based PEM Fuel Cell Catalyst Layers Saleh F.S., *$Easton E.B.
18:00 01574 Novel Core/Shell Design of PtRuIr Nanoparticles for DMFC Anode Catalyst Applications El Sawy E.N., *Birss V.I.
18:00 01576 Effect of the Nanostructure of Pt-loaded Colloid-imprinted Carbons (CICs) on the ORR Activity in PEM Fuel Cells Feng F., Banham D., Fürstenhaupt T., Pei K., Ye S., *Birss V.
18:00 01577 Beneficial Effect of H2S on Ni/YSZ SOFC Anode Performance at Intermediate Temperatures Addo P., Deleebeeck L., *Paulson S., $Birss V.
18:00 01578 Ethanol Oxidation with Binary PtMn/C and Ternary PtMnX/C (X=Fe, Co, Ni, Cu, Mo and, Sn) Alloys Catalysts Ammam M., Easton B.
18:00 01579 Optimization of Solid Oxide Fuel Cell Performance using Multiphysic Computation Manafi Rasi N., *Aslannejad H., Manafi Rasi S., Sadrameli S.M.
18:00 01580 Experimental Evaluation of the Operating Parameters Impact on the Performance of Anode-supported Solid Oxide Fuel Cell *Aslannejad H., Manafi Rasi N., Manafi Rasi S., Sadrameli S.M.
18:00 01581 Synthesis and Electrochemcial Study of Pd-based Nanomaterials for Hydrogen Storage Ostrom C.K., *Chen A.
18:00 01582 Durable Catalyst Supports for Proton Exchange Membrane Fuel Cells (PEMFCs) Abhayawardhana A.D., El-Sayed H.A., *$Birss V.I.
18:00 01583 Effect of Ligand Nature Used in the Synthesis of Non-Noble Metal ORR Catalysts Gharaibeh S., *$Birss V., Birss V.B.
18:00 01584 A Cesium-based Metal-Organic Framework Exhibiting Proton Conductivity Behaviour Wong N.E., $Shimizu G.K.H.
18:00 01585 Effect of the Wettability of Pt/Colloid-imprinted Carbon Catalysts on Oxygen Reduction Activity Li X., Banham D., Feng F., Forouzandeh F., Ye S., Kwok D. Y., *Birss V.
18:00 01586 Photophysics of a Metalloporphyrin as Model System to Study Upconversion Sensitizers in Solar Cells *Ponce C.P., $Paige M.F.
18:00 01587 Alkali Metal Ferrites for Solid Oxide Fuel Cell (SOFC) Anodes Penwell W.D., *Giorgi J.B.
18:00 01588 Y and Mn-Codoped Ceria as Advanced Electrodes for Solid Oxide Fuel Cells Handal H., *Thangadurai V.
18:00 01589 Fabrication of Porous YSZ Anode Support Structures via Tape Casting Method for SOFC Applications P.K. S., Paulson S., *Birss V.
18:00 01590 Sulfonated Poly(arylene ether) Ionomers for Use in Proton Exchange Membrane Fuel Cell Catalyst Layers Strong A., Le Marquand P., Huang W., *Xie Z., $Holdcroft S.
18:00 01591 Preparation, Characterisation and Activity of Pt/Carbon Powder Catalysts Synthesised by the Sacrificial Pt Counter Electrode Pt Deposition Method Francis S.A., *$Bergens S.H.

PT3 - Multiscale Bio/Physical/Chemical Modeling posters

18:00 01592 System Dependent Dispersion Coefficients Using the Concept of Atoms in Molecules Salahub D.R., Noskov S.Y., Sujith K.S.
18:00 01593 Modeling Nile Red Using OPLS All-Atom Force-Field Singh G., Mendez-Villuendas E., *$Tieleman D.P.
18:00 01594 ABC Transporters: A Computational Study Focused on the Inward-facing Conformation of the Human ABCB10 Transporter Corradi V., *$Tieleman D.P.
18:00 01595 A Theoretical Study of 1H NMR Chemical Shielding Tensors in Thiosemicarbazone Derivatives as Anticancer Drug Shaldozi Nobari S., Talei Bavil-Olyai M.R., Behzadi H.
18:00 01596 Theoretical Study of Carbon Nanotube - Self-assembling Organic Nanotube Composite Yamazaki T., Cho J.-Y., Fenniri H.
18:00 01597 Computational Study of Temperature Sensing by Model Peptides in Lipid Bilayers. *Moussatova A., $Tieleman D.P.
18:00 01598 Extreme Coarse Grained Molecular Dynamics Simulations of Induced Curvature Effects by M2 Influenza Protein Clusters on Model Cell Membranes *Mendez Villuendas E., $Tieleman D.P.
18:00 01599 Identification of New Fluorescent Probes to Detect Botulinum Neurotoxin Serotype A by Computer Aid Molecular Design Dadgar S., *Floriano W.
18:00 01600 Effects of Conjugate Thermal Fields in Molecular Dynamics Simulations of Ordering Processes Dittmar H., *$Kusalik P.
18:00 01601 A Computational Investigation of the Structure and Stability of DNA Strands Upon Incorporation of the C8-Bezothienyl-Guanine Adduct Wilson K.A., Millen A.L., Manderville R.A., Wetmore S.D.
18:00 01602 A Computational Study of the Deglycosylation of Natural and Damaged DNA Nucleotides Lenz S., Kellie J., *Wetmore S.D.

PT4 - Advances in Laser Analytical and Spectroscopic Techniques posters

18:00 01603 EC-QCL Photoacoustic Spectroscopy Revealed Additional Infrared Bands in Selected Polyaromatic Hydrocarbon Solids Oladepo S.A., *$Michaelian K.H.
18:00 01604 Sum Frequency Vibrational Spectroscopy of Organized Organic Monolayers:Polarization Mapping Provides New Insights.Sum Frequency Vibrational Spectroscopy of Organized Organic Monolayers:Polarization Mapping Burai T.N., Johansson T.P., Schiffer A., *$Leach G.W.
18:00 01605 An Apparatus for Phase-Senstive Interface Nonlinear Spectroscopy via Heterodyne Sum Frequency Generation Schiffer A., Burai T.N., *$Leach G.W.
18:00 01606 Study of H2-Elimination Pathways in the Catalytic Decomposition of Methylsilanes on a Hot Tungsten Filament Toukabri R., *Shi Y.J.
18:00 01607 Chirped-pulse and Cavity Based Fourier Transform Microwave Spectroscopy of the Methyl Lactate-ammonia Adduct Thomas J., Sukhorukov O., Jäger W., *$Xu Y.

PT5 - Solid State NMR posters

18:00 01608 A Computational Investigation of Spin-Spin Coupling Interactions Involving Three-Centre Two-Electron Bonds Bernard G.M., *$Wasylishen R.E.
18:00 01609 Sensitivity Enhancement of NMR Spectra of Quadrupolar Nuclei in Solids: I> 5/2 Nakashima T.T., *$Wasylishen R.E.
18:00 01610 35Cl Solid-State NMR Studies of Hydrochloride Pharmaceuticals and their Polymorphs Namespetra A.M., Hildebrand M., *$Schurko R.W., Hung I., Gan Z.
18:00 01611 2H/19F MAS NMR studies of MFT/D2O Suspensions *Sidhu P.S., $Hazendonk P., Wang S., Borisov A.S., Mikula R.
18:00 01612 First Principles Calculations and Solid-State NMR Studies fo Sodium Magnetic Shielding and Electric-Field Gradient Tensors. Teymoori R., Terskikh V.V., Wasylishen R.E.
18:00 01613 Elucidation of Hydrogen Bonding Network of Self-Assembled Rosette Nanotubes by Solid-State NMR Yan Z., Tikhomirov G.A., Bouatra S., Brouwer D.H., Myles A., *$Fenniri H.
18:00 01614 Obtaining Distance Information from High-Resolution Double-Rotation NMR of Quadrupolar Nuclei in Solids Perras F.A., *$Bryce D.L.
18:00 01615 Asphaltenes from Oil-Sands Bitumen: Investigating Structure by Solution- and Solid-State NMR Spectroscopy Dutta Majumdar R., *$Hazendonk P., Gerken M., Mikula R.
18:00 01616 14N, 31P, and 35/37Cl Solid-state Nuclear Magnetic Resonance Spectroscopy of Poly(dichlorophosphazene) Borisov A.S., Sun C., $Hazendonk P., *Hayes P.G.
18:00 01617 Recent Advances in Ultra-Wideline 195Pt Solid-State NMR Lucier B.E.G., Reidel A.R., Harris K.J., Johnston K.E., Autschbach J., *$Schurko R.W.
18:00 01618 6,7Li Solid State NMR Studies of Lithium-Ion Environment and Dynamic Process in Li2MP2O7(M=Fe, Mn) as New Series of Cathode Material for Lithium-Ion Batteries He X.
18:00 01619 Investigation of Solid and Solution Complexes of b-cyclodextrin and Perfluorooctanoic Acid Karoyo A.H., Sidhu P., Borisov A.S., $Hazendonk P., *Wilson L.D.
18:00 01620 NMR Spectroscopic Studies of D2O in Sulfonated Poly(ether ether ketone) Fuel Cell Membranes Woudstra J.M., *$Ooms K.J.
18:00 01621 2H Double and Zero Quantum Filtered NMR Spectroscopy of D2O in Collagen VanderSchee C.R., *$Ooms K.J.
18:00 01622 Determination of Structural and Dynamic Information from NMR Spectral Parameters Via DIVAM Opyr M.P., Montina A.D., $Hazendonk P.

PT6 - Physical and Biophysical Mass Spectrometry posters

18:00 01623 Charge Transfer Dynamics in Bridged Donor-Acceptor Molecular Assemblies El-Dali A., Bodwell G.J., Kudale A.
18:00 01624 Structure and Fragmentation of [Zn(A-H)(A)]+ Complexes in the Gas Phase: Loss of H2 when A Contains a Secondary Amine *Gholami A., $Fridgen T.D.
18:00 01625 The Generation of Metal Anions by Organic Acid Decarboxylation in the Gas Phase *Hassan D., Mungham A., Curtis S., Renaud J., $Mayer P.

PT7 - Diversity and Challenges of Inorganic Molecular Modelling posters

18:00 01626 A Combined Experimental/Theoretical Approach to Homogeneous Palladium Catalyst Development for Butadiene Telomerization Jabri A., $Budzelaar P.H.M.
18:00 01627 Adventures in Uranyl Chemistry: Structure, Oxo-functionalization and Electronic Structure Odoh S.O., *$Schreckenbach G., Pan Q.J., Arnold P.L., Love J.B.
18:00 01628 Towards a Polarizable Force Field for Modeling Ionic Liquids Fuel Desulfurization Processes Riahi S., *$Rowley C., Rowley Christoph
18:00 01629 Benzene Hydrogenation on Mo-terminated a-Mo2C (100) Surface, a Density Functional Theory Study $Liu X., Tkalych A., Zhou B., *Salahub D.
18:00 01630 CO Oxidation and NO Reduction on a MgO(100) Supported Pd Cluster: A Quantum Chemical Molecular Dynamics Study *$Ahmed F., Miura R., Hatakeyama N., Takaba H., Miyamoto A.
18:00 01631 Population Analyses Based on Ionic Partition of Overlap Distributions (IPOD) Chen Y.K., *$Wang Y.A.
18:00 01632 17O Solid-State NMR Studies of Layered Double Hydroxides (LDHs) Li Z., Guiyun Y., *Luming P., Frédéric B., Clare G.P., Weiping D., Xuefeng G., Wenhao D., Nianhua X., $Zhe Q., Sheng T.
18:00 01633 Study of Deuterium Isotope Effects on Acid-Base Equilibria Egorova Y., *$Mora-Diez N., Tremaine P.R.


Biophysical Chemistry (joint with BM2)

13:40 See BM2.

16:40 End of Session

PTTELUS 108,109

Electrochemistry with Chemically Modified Surfaces and Non-traditional Techniques (joint with AN2)

13:40 See AN2.

16:40 End of Session

PTMacleod A2,3

Fire and Ice: Atmospheric Chemistry from Biomass Burning to Ice Aerosols (joint with EN2)

13:40 See EN2.

17:00 End of Session

PTGlen 209

Surfaces of Nanostructures, Nanostructured Surfaces (joint with SS1)

13:20 See SS1.

16:40 End of Session

SS1Glen 209

Surfaces of Nanostructures, Nanostructured Surfaces (joint with PT)

Organizer(s) - R. Scott, Y. Hu
Chair(s) - R. Scott; P. Kruse

13:20 01634 On the Characterisation of Core-shell Nanoparticles and Quantum Dots; Progress and Challenges *$Van Veggel F.C.J.M.
14:00 01635 Simple Magnetic Nanoparticles with Complex Surfaces: Easily Recyclable Catalysts for Selective Organic Transformations Hudson R., Rivière A., Cirtiu C.M., Luska K.L., Ishikawa S., *Li C.-J., $Moores A.
14:20 01636 "Self-Healing Coatings": The Role of Molecular Mobility at Oxide Surfaces *$Kruse P., Chowdhury T.
14:40 01637 A Mechanistic Look at the Visible-Light Initiated Hydrosilylation Reaction on Nanocrystalline Silicon Huck L.A., *Buriak J.M.
15:00 01638 Defect-Induced Size-Dependent Photoluminescence Properties of Colloidal Transparent Conducting Oxide Nanocrystals Wang T., Hegde M., Farvid S.S., *$Radovanovic P.V.
15:40 Coffee Break
16:00 01639 Measuring the Adhesive Properties of Biomimetic Surfaces Zhou J.H.W., Zhang C., Sameoto D., Zhang X., Li Y., Ng H.W., Menon C., *$Gates B.D.
16:20 01640 Incorporating Phosphonium Salts in to UV-curable Formulations: Accessing the Surface Charges Guterman R., $Ragogna P.J.
16:40 End of Session

SS-PoExhibition Hall CD

Poster Session

From 18:00 until 19:30

SS1 - Surfaces of Nanostructures, Nanostructured Surfaces posters

18:00 01641 Characterization of Helical Rosette Nanotubes by Scanning Tunnelling Microscopy *Cho J.-Y., $Fenniri H., Borzsonyi G., Hemraz U.
18:00 01642 Energy and Conformation of Glycinate (NH2CH2COO-) on Cu(110) Abd-El-Aziz A., *$Jack D.B.
18:00 01643 Molecular Orientation in Monolayer H2 on Ionic Surfaces Kootnekoff B.A., Makins C., Hawrylo J., *$Jack D.B.
18:00 01644 Surface Sciences Studies on Shale/Tight Gas Reservoir using TEM and XPS Analyzes *Aquino S., Birss V., Clarkson C.
18:00 01645 Amine-Functionalized Silicon Nanocrystals Yang Z., Dasog M., *$Veinot J.G.C.
18:00 01646 Paramagnetic Silver! Fabrication of Paramagnetic Films from Diamagnetic Metals Marenco A.J., *$Pedersen D.B., Trudel S.
18:00 01647 Surface Modification of Gold and Silver Nanoparticles with Controllable Thickness Laurentius L., *$McDermott M.T.
18:00 01648 Investigating the Interaction between Proteins and Nanocrystalline Celluloses (NCCs) Cao C., *Kaufman G., $McDermott M.T.
18:00 01649 PtPd Core-Shell Nanoparticles as Catalysts for Selective Alcohol Oxidations and Electrocatalysts for Oxygen Reduction Reactions Balcha T., $Scott R.
18:00 01650 Displacement of Thiol-Derived SAMs on Gold by Aryldiazonium Cations Kebede A., *$McDermott M.T.
18:00 01651 The Effect of n-Alkane Chain Length and Substrate Temperature on the Epitaxial Growth of Oriented n-Alkane Thin Films on Graphite $Masnadi M., *Urquhart S.G.
18:00 01652 Method to Control Orientation Order in n-alkane Films $Zuhaib A., *Urquhart S.G.
18:00 01653 Surface Dependence of Magnetism in Thiol Monolayer-coated Gold Thin Film Dong R., $Trudel S.
18:00 01654 Electrochemical Study of Malathion in the Presence of Electrochemically Fabricated Ag Nanostructures Vijayaratnam C., Fathi F., *Kraatz H.B.

SS2 - Chemical Nanopatterning of Surfaces: Fundamentals and Applications posters

18:00 01655 Investigating Structures, Spectroscopy and Photopolymerization Kinetics of Perfluorotetradecanoic:10,12-Pentacosadiynoic Acids Mixtures at Air-Water and Air-Solid Interfaces *Paige M., $Younesi Araghi H.
18:00 01656 Rapid Production of Alkylsilane Monolayers on Silicon Oxide Surfaces Ng H.W., Liu A., Gong Y., *$Gates B.D.

SSTELUS 108,109

Electrochemistry with Chemically Modified Surfaces and Non-traditional Techniques

13:40 Joint with AN and PT - see AN2.

16:40 End of Session

Top of Conference Schedule

Bold text denotes the presenting author.   If present, * denotes the corresponding author and $ denotes the principal investigator.

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