Ab initio cakulatiuns using the restricted Roothaan open-shell method indicate that the energy separation between the rawest two triplet states of formamide, and their conforma~on~ preferences, depend significantly upon the @~metry of the molecule.
Conformational energy surfaces of triplet-state isomeric methyloxiranes
✍ Scribed by G. R. Demaré; M. R. Peterson; I. G. Csizmadia; O. P. Strausz
- Publisher
- John Wiley and Sons
- Year
- 1980
- Tongue
- English
- Weight
- 576 KB
- Volume
- 1
- Category
- Article
- ISSN
- 0192-8651
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