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Ab initio molecular orbital study of the hydrogen, lithium, and fluorine derivatives of nitric oxide

✍ Scribed by Peslak, John; Klett, D. S.; David, C. W.


Book ID
126154900
Publisher
American Chemical Society
Year
1971
Tongue
English
Weight
584 KB
Volume
93
Category
Article
ISSN
0002-7863

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Ab initio molecular orbital study of the
✍ Henri Lumbroso; Giuseppe Concetto Pappalardo πŸ“‚ Article πŸ“… 1980 πŸ› John Wiley and Sons 🌐 English βš– 500 KB

## Abstract The total dipole moments, molecular energies, and π‐electron densities for the linear and orthogonal pyrrole ⃛acetonitrile hydrogen‐bonded complexes were studied in the __ab initio__ valence bond framework using the minimal STO‐3G basis set. That the orthogonal conformation, although sl