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Ab initio SCF study of the photochemical disrotatory closure of butadiene to cyclobutene

โœ Scribed by Grimbert, D.; Segal, G.; Devaquet, A.


Book ID
127321570
Publisher
American Chemical Society
Year
1975
Tongue
English
Weight
524 KB
Volume
97
Category
Article
ISSN
0002-7863

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An ab-initio SCF study of the binding of
โœ J.F. Hinton; A. Beeler; D. Harpool; R.W. Briggs; A. Pullman ๐Ÿ“‚ Article ๐Ÿ“… 1977 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 356 KB

The binding energy of the Li+ ion to twenty-two molecules with basic functional groups has been calculated using abinitio SCF techniques. The bases studied represent a number of different types of functiona! groups, i.e. -0 Z-N. x. -8-0, -0-, -N:, -eN and -N=. The calculated binding energies compare