Theoretical studies of C-NH2 bond dissociation energies for some amino compounds

Journal of Molecular Structure: THEOCHEM

Volumn 766, Issue 2-3, 2006, Pages 87-92

  Zhao, Jun ^a   Cheng, Xinlu ^a   Yang, Xiangdong ^a  

^a SICHUAN UNIVERSITY   (China)

Author keywords

Amino compounds; Bond dissociation energy; CBS Q method; Density functional theory; Equilibrium structure

Indexed keywords

EID: 33746681180     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2006.04.007     Document Type: Article

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