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Determination of the helical screw sense and side-group chirality of a synthetic chiral polymer from Raman optical activity
Authors:Merten Christian  Barron Laurence D  Hecht Lutz  Johannessen Christian
Institution:1. Department of Chemistry, University of Alberta, Edmonton, AB T6G?2G2 (Canada);2. Frauenhofer Institute for Manufacturing Technology and Advanced Materials (IFAM), 28359 Bremen (Germany);3. WestCHEM, School of Chemistry, University of Glasgow, Glasgow G12?8QQ (UK);4. Manchester Interdisciplinary Biocentre, University of Manchester, 131 Princess Street, Manchester M1?7DN (UK)
Abstract:Splitting it up: Excellent agreement between the experimental and the quantum-chemically simulated Raman optical activity (ROA) spectrum of (+)-poly(trityl methacrylate) shows that the polymer backbone adopts a left-handed helical conformation while the trityl side groups display a left-handed propeller conformation. Thus ROA can be used to determine the complete structure of synthetic chiral polymers in solution.
Keywords:chiral polymers  density functional theory  helical chirality  Raman optical activity
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