Journal of the American Chemical Society p. 6850 - 6857 (1992)
Update date:2022-07-30
Topics:
Pickard, Simeon T.
Smith, Howard E.
Polavarapu, Prasad L.
Black, Thomas M.
Rauk, Arvi
Yang, Danya
Both enantiomers of trans-2,3-dimethyloxirane-d0, trans-2,3-dimethyloxirane-d2, and trans-2,3-dimethyloxirane-2,3-d2 are synthesized. Vibrational circular dichroism (VCD) spectra for these compounds are obtained in the 1600-700-cm-1 region. Ab initio theoretical calculations using the localized molecular orbital method (LMO-VCD) and the vibronic coupling theoretical method (VCT) are also obtained for these molecules. A comparison of the theoretical VCD predictions with the corresponding experimental observations demonstrates that the observed VCD features are satisfactorily reproduced by the theories, indicating that absolute configurations can be confidently determined using vibrational circular dichroism.
View MoreBrightGene Bio-Medical Technology Co., Ltd.
website:https://en.bright-gene.com/
Contact:+86-512-62551801
Address:Building C25 - C31, No. 218 Xinghu Road, Suzhou Industrial Park, Suzhou, Jiangsu, China.
Lianyungang Ningkang Chemical Co., Ltd
Contact:.+86-518-88588008
Address:http://www.chemnk.com
Jiangsu Willing Bio-Tech Co ltd
website:http://www.willingbio.com/
Contact:+86 18796909136--
Address:No 18 Guoqiao Road
Qingdao Kingway Pharmtech Co., Ltd.
Contact:86-532-87118899
Address:No. 88, Middle Haixi Road, Jiaonan City, Qingdao, China
Contact:86-310-8067016
Address:East Fuhua Road,Tiexi Chemical Industrial Estate,Hebei,China
Doi:10.1016/j.tet.2013.01.064
(2013)Doi:10.1021/om200602k
(2011)Doi:10.1021/om400046r
(2013)Doi:10.1021/acs.orglett.8b00196
(2018)Doi:10.1021/ja311430r
(2013)Doi:10.1055/s-0032-1318300
(2013)