1969 Stokr CHM PvcModels - ebyte.it · Title: Microsoft Word - 1969_Stokr_CHM_PvcModels.doc Author:...
Transcript of 1969 Stokr CHM PvcModels - ebyte.it · Title: Microsoft Word - 1969_Stokr_CHM_PvcModels.doc Author:...
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Molecular Spectra and Conformational Structure
of 2,3-Dichlorobutane and 3,4-Dichlorohexane
Stokr J., Doskocilova D., Sykora S., Hörhold H.H., Schneider B.
Collection of Czechoslovak Chemical Communications, Vol.34, pp 1875-1890 (1969)
This copy, scanned from an Author’s reprint, is for personal perusal only.
Other uses require permission of
Collection of Czechoslovak Chemical Communications.
For other works of the Author, please visit www.ebyte.it.
Abstract
Infrared and NMR spectra of the stereoisomers of 2,3-dichloro- and 2,3-dibromobutane, and of 3,4-
dichloro- and 3,4-dibromohexane have been measured in a broad temperature range.
Conformational structure with respect to rotation around the 2,3-bond in the butanes, and the 3,4-
bond in the hexanes has been determined in the solid and liquid state, and compared with the results
of semiempirical conformer energy calculations.
Keywords: PVC models, NMR, IR, Stereo conformations, Molecular dynamics, Dichlorobutane,
Dichlorohexane
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