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Absolute Configuration of Bromochlorofluoromethane from Experimental and Ab Initio Theoretical Vibrational Raman Optical Activity
Abstract
After more than 100 years, the absolute configurations of the dextro- and levorotatory enantiomers of bromochlorofluoromethane 1, one of the simplest chiral molecules, have now been determined. Comparison of the measured Raman optical activity spectrum (in the range of vibrational modes) of an enantiomerically enriched sample of 1 with the calculated spectra allow the assignments (S)-(+) and R-(−) to be made.
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Citations
Cited by
Molecular Light Scattering and Optical Activity
Barron, L. D. (2004) · Cambridge University Press eBooks · doi:10.1017/cbo9780511535468 · Cited by 2,333
Self-citationThe Assignment of Absolute Configuration by NMR
Seco, J. M., Quiñoá, E., & Riguera, R. (2004) · Chemical Reviews · doi:10.1021/cr000665j · Cited by 983
Ab initio calculation of molecular chiroptical properties
Crawford, T. D. (2006) · Theoretical Chemistry Accounts · doi:10.1007/s00214-005-0001-4 · Cited by 397
Absolute Asymmetric Synthesis under Physical Fields: Facts and Fictions
Avalos, M., Babiano, R., Cintas, P., Jiménez, J. L., Palacios, J. C., & Barron, L. D. (1998) · Chemical Reviews · doi:10.1021/cr970096o · Cited by 306
Self-citationSelenocysteine in Native Chemical Ligation and Expressed Protein Ligation
Hondal, R. J., Nilsson, B. L., & Raines, R. T. (2001) · Journal of the American Chemical Society · doi:10.1021/ja005885t · Cited by 278
Metadata
- Authors
- Costante, J., Hecht, L., Polavarapu, P. L., Collet, A., & Barron, L. D.
- Venue
- Angewandte Chemie International Edition in English
- Publisher
- Wiley
- Published
- 1997-05-02
- Volume
- 36
- Issue
- 8
- Pages
- 885-887
- ISSN
- 0570-0833 (ISSN-L)
- OpenAlex
- W2153147080
- Cited by
- 168
- References
- 0
- FWCI
- 5.59
- Type
- journal article
- Language
- en
- Open access
- closed
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- Costante, J., Hecht, L., Polavarapu, P. L., Collet, A., & Barron, L. D. (1997). Absolute Configuration of Bromochlorofluoromethane from Experimental and Ab Initio Theoretical Vibrational Raman Optical Activity. Angewandte Chemie International Edition in English. https://doi.org/10.1002/anie.199708851
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