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The correlation of 11B NMR ASIS effects with MO‐derived charge densities for closo‐C2B5H7 and some chloro derivatives

The correlation of 11B NMR ASIS effects with MO‐derived charge densities for closo‐C2B5H7 and... Aromatic‐solvent‐induced 11B NMR shifts (11B ASIS effects), observed for closo‐2, 4‐C2B5H7 and its 5‐chloro and 5, 6‐dichloro derivatives, are correlated to ab initio STO‐3G derived atom charge densities. A near linear relationship is found upon incorporating nearestneighbor charge density contributions. http://www.deepdyve.com/assets/images/DeepDyve-Logo-lg.png Heteroatom Chemistry Wiley

The correlation of 11B NMR ASIS effects with MO‐derived charge densities for closo‐C2B5H7 and some chloro derivatives

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References (15)

Publisher
Wiley
Copyright
Copyright © 1992 Wiley Subscription Services
ISSN
1042-7163
eISSN
1098-1071
DOI
10.1002/hc.520030304
Publisher site
See Article on Publisher Site

Abstract

Aromatic‐solvent‐induced 11B NMR shifts (11B ASIS effects), observed for closo‐2, 4‐C2B5H7 and its 5‐chloro and 5, 6‐dichloro derivatives, are correlated to ab initio STO‐3G derived atom charge densities. A near linear relationship is found upon incorporating nearestneighbor charge density contributions.

Journal

Heteroatom ChemistryWiley

Published: Jan 1, 1992

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