S-H proton dissociation enthalpies of thiophenolic cation radicals: A DFT study

Journal of Molecular Structure: THEOCHEM

Volumn 663, Issue 1-3, 2003, Pages 167-174

  Zhang, Hong Yu ^a   Ji, Hong Fang ^b  

^a SHANDONG UNIVERSITY OF TECHNOLOGY   (China)

^b SHANDONG NORMAL UNIVERSITY   (China)

Author keywords

Bond dissociation enthalpy; Density functional theory; Electronic effect; Proton dissociation enthalpy; Thiophenolic cation radical; Thiophenols

Indexed keywords

CATION; RADICAL; THIOPHENOL DERIVATIVE;

ANALYTIC METHOD; ARTICLE; CHEMICAL BOND; DENSITY; DISSOCIATION; ELECTRON TRANSPORT; ELECTRONICS; ENTHALPY; SUBSTITUTION REACTION; THEORY;

EID: 0344442260     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2003.08.124     Document Type: Article

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