On the enthalpies of homolytic and heterolytic S-H bond cleavage in para and meta substituted thiophenols

Computational and Theoretical Chemistry

Volumn 967, Issue 2-3, 2011, Pages 273-283

  Rimarčík, Ján ^a   Lukeš, Vladimír ^a   Klein, Erik ^a   Rottmannová, Lenka ^a  

^a SLOVAK UNIVERSITY OF TECHNOLOGY   (Slovakia)

Author keywords

Bond dissociation enthalpy; DFT; Ionization potential; Proton affinity; Proton dissociation enthalpy

Indexed keywords

EID: 84555190362     PISSN: 2210271X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.comptc.2011.04.029     Document Type: Article

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