Identity hydride-ion transfer from C-H donors to C acceptor sites. Enthalpies of hydride addition and enthalpies of activation. Comparison with C⋯H⋯C proton transfer. An ab initio study

Journal of the American Chemical Society

Volumn 127, Issue 7, 2005, Pages 2324-2333

  Gronert, Scott ^a   Keeffe, James R ^a  

^a SAN FRANCISCO STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ANALYSIS; HYDRIDES; IONS; MOLECULAR STRUCTURE; REACTION KINETICS; RESONANCE;

HYDROGEN TRANSFER; ION ACCEPTORS; PROTON TRANSFER; RESONANCE STABILIZATION; TRANSITION STATES;

ENTHALPY;

BORANE DERIVATIVE; CARBON; CARBONYL DERIVATIVE; HYDROGEN; ION; PROTON;

AB INITIO CALCULATION; ARTICLE; CALCULATION; CHEMICAL BOND; CHEMICAL REACTION; CORRELATION ANALYSIS; ENTHALPY; GEOMETRY; ION TRANSPORT; MEASUREMENT; MOLECULAR STABILITY; PROTON TRANSPORT; REACTION ANALYSIS;

EID: 13944270948     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja044002l     Document Type: Article

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