Bond polarizability calculations of the Raman optical activity of (R)-(+)-3-methylcyclohexanone

Barron, L.D. and Clark, B.P. (1982) Bond polarizability calculations of the Raman optical activity of (R)-(+)-3-methylcyclohexanone. Journal of Raman Spectroscopy, 13(2), pp. 155-159. (doi:10.1002/jrs.1250130211)

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Abstract

The bond polarizability theory of Raman optical activity is used to calculate the complete Raman optical activity spectrum of (R)-(+)-3-methylcyclohexanone. The results are compared with the observed depolarized Raman circular intensity difference spectrum in the region 50-1800 cm−1. The predictions are better in the upper half of this range probably because at lower frequency the calculated normal coordinates are less reliable and the contributions from carbonyl deformations increase.

Item Type:Articles
Status:Published
Refereed:Yes
Glasgow Author(s) Enlighten ID:Barron, Professor Laurence
Authors: Barron, L.D., and Clark, B.P.
College/School:College of Science and Engineering > School of Chemistry
Journal Name:Journal of Raman Spectroscopy
Publisher:Wiley
ISSN:0377-0486
ISSN (Online):1097-4555

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