Interactions in 1-ethyl-3-methyl imidazolium tetracyanoborate ion pair: Spectroscopic and density functional study

Journal of Molecular Structure

Volumn 1038, Issue , 2013, Pages 12-18

  Mao, James X ^a   Lee, Anita S ^b   Kitchin, John R ^b   Nulwala, Hunaid B ^c   Luebke, David R ^c   Damodaran, Krishnan ^a  

^a UNIVERSITY OF PITTSBURGH   (United States)

^b CARNEGIE MELLON UNIVERSITY   (United States)

^c NATIONAL ENERGY TECHNOLOGY LABORATORY   (United States)

Author keywords

Emim + TCB ; Density Functional Theory; Infrared spectroscopy; Ionic liquids; NBO; Raman spectroscopy

Indexed keywords

[EMIM]+[TCB] -; DENSITY-FUNCTIONAL STUDY; ELECTRON DENSITY ANALYSIS; EQUILIBRIUM POSITIONS; NBO; POTENTIAL ENERGY DISTRIBUTION; RAMAN AND INFRARED SPECTRA; ROOM TEMPERATURE IONIC LIQUIDS;

DENSITY FUNCTIONAL THEORY; HYDROGEN BONDS; INFRARED SPECTROSCOPY; RAMAN SPECTROSCOPY;

IONIC LIQUIDS;

EID: 84873706643     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2013.01.046     Document Type: Article

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