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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