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Fluorine nuclear spin coupling constants in fluoro-substituted furans

Authors :
I. Brown
D.W. Davies
Source :
Chemical Physics Letters. 37:132-134
Publication Year :
1976
Publisher :
Elsevier BV, 1976.

Abstract

In order to assist experimental assignments in olefinic and aromatic fluorine compounds, fluorine nuclear coupling constants have been obtained from the first-order self-consistent perturbation theory equation with the INDO molecular orbital approximation in a series of fluoro-substituted furans. There is a clear distinction between the magnitudes and signs for the four fluorine coupling positions; the importance of the orbital and spin-dipolar contributions is very clear. Tentative signs are suggested for all the coupling constants.

Details

ISSN :
00092614
Volume :
37
Database :
OpenAIRE
Journal :
Chemical Physics Letters
Accession number :
edsair.doi...........ce194c1de0a235b7e4d70f11be807135
Full Text :
https://doi.org/10.1016/0009-2614(76)80177-7