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DFT Study and Monte Carlo Simulation on the Aminolysis of XC(O)OCH 3 (X = NH 2 , H, and CF 3 ) with Monomeric and Dimeric Ammonias
Xia, Xuefei, Zhang, Chenghua, Xue, Ying, Kim, Chan Kyung, Yan, GuosenVolume:
4
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct800099a
Date:
October, 2008
File:
PDF, 617 KB
english, 2008