An ab initio SCF study of the rotational isomerism in propargyl amine and amino-acetonitrile
β Scribed by P. Palmieri; A.M. Mirri
- Publisher
- Elsevier Science
- Year
- 1977
- Tongue
- English
- Weight
- 321 KB
- Volume
- 37
- Category
- Article
- ISSN
- 0022-2860
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π SIMILAR VOLUMES
The structures of the methyl and silyl amines and phosphines and their ions have been calculated using ab-initio SCF theory and the 3-216: basis set. The computed structures give excellent agreement with the available experiment data without the inclusion of d functions, with the exception of (SiH3)
## Abstract On the basis of previous experimental and theoretical studies of lowβmolecular models of living poly(methyl methacrylate) and their coordination interactions, molecular states preceding and involving the propagation step of the anionic polymerization of methyl methacrylate (MMA) were in