VIBRATIONAL CIRCULAR DICHROISM CALCULATIONS IN SELECTED SMALL MOLECULES
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Publisher:Ohio State University
Vibrational circular dichroism calculations using a fixed partial charge model applied to the results of a normal coordinate analysis will be presented for the series of molecules, 1,1,1-bromochlorofluoroethane, 1,1-chlorofluoroethane and alanine. The results of these calculations will be compared to the experimentally determined VCD spectrum of alanine in the hydrogen stretching region.
Author Institution: Department of Chemistry, Syracuse University
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