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Structural and Mechanistic Organic Chemistry: A Tribute to Professor Norman L. Allinger

✍ Scribed by Schleyer, P. R.; Schaefer, H. F.


Book ID
118209663
Publisher
Taylor and Francis Group
Year
1996
Tongue
English
Weight
50 KB
Volume
88
Category
Article
ISSN
0026-8976

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πŸ“œ SIMILAR VOLUMES


Ab initio studies of structural features
✍ J. N. Scarsdale; H. L. Sellers; Lothar SchΓ€fer; Norman L. Allinger πŸ“‚ Article πŸ“… 1982 πŸ› John Wiley and Sons 🌐 English βš– 318 KB πŸ‘ 1 views

## Abstract The molecular structure of the stretched form of __n__‐nonane, as a typical long‐chain hydrocarbon, was refined by geometrically unconstrained __ab initio__ force relaxation on the 4‐21G level. The Cο£ΏC bonds and Cο£ΏH bond distances in the interior of the hydrocarbon chain are found to be