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Computational study of relative bond strengths and stabilities of a series of amine and nitro derivatives of triprismane and some azatriprismanes

✍ Scribed by Murray, Jane S.; Concha, Monica; Seminario, Jorge M.; Politzer, Peter

Book ID
120385577
Publisher
American Chemical Society
Year
1991
Tongue
English
Weight
540 KB
Volume
95
Category
Article
ISSN
0022-3654

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A computational analysis of the electros
A computational analysis of the electrostatic potentials and relative bond strengths of hydrazine and some of its 1,1-dimethyl derivatives
✍ Jane S. Murray; Nagamani Sukumar; Shoba Ranganathan; Peter Politzer πŸ“‚ Article πŸ“… 1990 πŸ› John Wiley and Sons 🌐 English βš– 900 KB

## Abstract We have carried out a computational study of hydrazine and five of its 1,1‐dimethyl derivatives, focusing on their electrostatic potentials and relative bond strengths. Our approach has involved the calculation of ab initio self‐consistent‐field molecular orbital wave functions and mole