QTAIM characteristics of halogen bond and related interactions

Journal of Physical Chemistry A

Volumn 116, Issue 7, 2012, Pages 1838-1845

  Grabowski, Sławomir J ^a,b  

^a UNIVERSITY OF THE BASQUE COUNTRY UPV EHU   (Spain)

^b BASQUE FOUNDATION FOR SCIENCE   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; BENT'S RULE; CL ATOMS; DUAL ROLE; ELECTRON CHARGE REDISTRIBUTION; ELECTROSTATIC POTENTIALS; ENERGETIC PARAMETERS; HALOGEN BONDS; HYDROGEN-BOND FORMATION; LEWIS ACID; LEWIS BASE; NON-COVALENT INTERACTION; POSITIVE REGION; QUANTUM THEORY OF ATOMS IN MOLECULES;

CHLORINE; HYDROGEN BONDS; QUANTUM THEORY;

COMPLEXATION;

FLUOROCARBON; HALOGEN;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; HYDROGEN BOND;

FLUOROCARBONS; HALOGENS; HYDROGEN BONDING; MODELS, MOLECULAR;

EID: 84857416698     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp2109303     Document Type: Article

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