Theoretical study of (CH⋯C)- hydrogen bonds in CH 4-nXn (X = F, Cl; n = 0, 1, 2) systems complexed with their homoconjugate and heteroconjugate carbanions

Journal of Physical Chemistry A

Volumn 109, Issue 51, 2005, Pages 12006-12013

  Chandra, Asit K ^a   Zeegers Huyskens, Thérèse ^b  

^a NORTH EASTERN HILL UNIVERSITY   (India)

^b UNIVERSITY OF LEUVEN   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; CARBON; ELECTROSTATICS; ENTHALPY; MOLECULAR VIBRATIONS; NEGATIVE IONS; PROTONS;

DEPROTONATION ENTHALPIES (DPE); ELECTRONIC REORGANIZATION; HETEROCONJUGATE CARBANIONS; HYBRIDIZATION OF THE C BONDED TO HB; NEUTRAL MOLECULES; PROTON AFFINITIES;

HYDROGEN BONDS;

ANION; CARBON; CHLORINE; CHLOROFLUOROCARBON; FLUORINE; HYDROGEN;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; HYDROGEN BOND; MACROMOLECULE; THEORETICAL MODEL; THERMODYNAMICS;

ANIONS; CARBON; CHLORINE; CHLOROFLUOROCARBONS, METHANE; COMPUTER SIMULATION; FLUORINE; HYDROGEN; HYDROGEN BONDING; MACROMOLECULAR SUBSTANCES; MODELS, THEORETICAL; MOLECULAR STRUCTURE; THERMODYNAMICS;

EID: 30344480791     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp054123n     Document Type: Article

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