共 50 条
- [31] AM1 and PM3 semi-empirical study of the Diels-Alder reaction between N-, P-, O- and S-substituted aromatic heterocyclic five-membered rings with acrolein JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2004, 672 (1-3): : 35 - 43
- [36] Semi-empirical AM1 and PM3 molecular orbital calculations on the mechanism of the hydrolysis of unsaturated lactones: Substituted (E)-5,5'-diphenylbifuranylidenediones and 3,7-diphenylpyrano[4,3-c]pyran-1,5-diones JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1997, (03): : 547 - 552
- [39] Semi-empirical (PM3 and AM1) and ab initio molecular orbital calculations of 1,2,4-oxadiazoles, 4,5-dihydro-1,2,4-oxadiazoles and 4,4-di-n-butyl-2-phenylbenzo-1,3-oxazine JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2003, 640 : 49 - 56