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Ab initio SCF treatment of allyl anion and distorted propenyl anions

✍ Scribed by Boerth, Donald W.; Streitwieser, Andrew

Book ID
126963248
Publisher
American Chemical Society
Year
1978
Tongue
English
Weight
622 KB
Volume
100
Category
Article
ISSN
0002-7863

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Ab milio SCF and CI calculations usmg a double-zeta plus polarrwr~on bans SIX hdx,s been prrlormed on the chlorms difluoride cation (GIFT ) and the anion (CIF; ) to determine [heir ground-slate electrontc structure The ClF;l ran IF predfcwd lo have a suongly benr (G,) swucmre (bond angle -Leo) and t