Mechanism of TBD-catalyzed hydrolysis of acetonitrile

Journal of Molecular Structure: THEOCHEM

Volumn 911, Issue 1-3, 2009, Pages 40-45

  Ma, Jun ^a,b   Zhang, Xuelan ^a,b   Zhao, Ning ^a   Xiao, Fukui ^a   Wei, Wei ^a   Sun, Yuhan ^a  

^a INSTITUTE OF COAL CHEMISTRY   (China)

^b UNIVERSITY OF CHINESE ACADEMY OF SCIENCES   (China)

Author keywords

Acetonitrile hydrolysis; Catalysis mechanism; DFT; NBO; TBD

Indexed keywords

EID: 68849086349     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2009.06.033     Document Type: Article

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