DFT study on the molecular mechanism of the [4+ 2] cycloaddition between thiobenzophenone and arylalkenes via radical cations

LR Domingo, R Pérez-Ruiz, JE Argüello…

文献索引：Liao, Li-Fan; Tseng, Pen-Wen; Chou, Chin-Hsing; Chou, Wen-Chih; Fang, Jim-Min Heterocycles, 1995 , vol. 41, # 9 p. 1967 - 1978

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被引用次数: 11

摘要

... Volume: Page: ... DFT calculations were carried out using the B3LYP(9) exchange-correlation functional together with the standard 6-31G* basis set.(10 ... step, ring closure would be achieved via TS2a−c with formation of the new six-membered heterocycle 3a−c ...