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The determination of conformational effects in some fluorobenzenes by a combined mo/coupling constant treatment

✍ Scribed by Raymond J. Abraham; James F. Busby; M. Ashley Cooper; Anthony M. Roe

Publisher
John Wiley and Sons
Year
1974
Tongue
English
Weight
185 KB
Volume
6
Category
Article
ISSN
0749-1581

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✦ Synopsis

Abstract

The correlation of J~meta~^FF^ in some 1‐substituted‐2,6‐difluorobenzenes (1) with the bond order matrix of the fluorine 2p(π) orbitals provides information on the orientation of the substituents and the position of the counter‐ion in the anilinium salt. The calculated charge densities in the analogous anilinium fluoride ion pair are compared with those of the free ion and neutral molecule.

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