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A theoretical approach to substituent effects. Examination of phenoxides and anilides as models for benzyl anions

✍ Scribed by Kemister, Gary; Pross, Addy; Radom, Leo; Taft, Robert W.


Book ID
126487231
Publisher
American Chemical Society
Year
1980
Tongue
English
Weight
692 KB
Volume
45
Category
Article
ISSN
0022-3263

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A theoretical approach to substituent ef
✍ Addy Pross; Leo Radom πŸ“‚ Article πŸ“… 1980 πŸ› John Wiley and Sons 🌐 English βš– 491 KB

## Abstract __Ab initio__ molecular orbital theory is used to examine the effect of substituents on bond lengths in mono‐ and disubstituted methanes. The relative importance of electrostatic and orbital interaction terms are assessed. The results suggest that for substituents (X) which show powerfu