A theoretical study of the CSH4 and CPH5 hypersurfaces. Geometries, tautomerization, and dissociation of sulfonium and phosphonium ylides
DJ Mitchell, S Wolfe…
Index: Anders, Ernst; Clark, Timothy; Gassner, Thomas Chemische Berichte, 1986 , vol. 119, # 4 p. 1350 - 1360
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Citation Number: 36
Abstract
... Calcula- tions are also reported for the staggered conforma- tions of the protonation products CH3SH,+ and CH3PH3+. Thevariousgeometriesandtotalenergies of the two heavy-atom sulfur and phosphorus ... VOL. 59, 1981 ... Molecule Parameter STO-3G STO-3G* 4-3 1 G 4-31G* ...
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