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Journal of Molecular Structure: THEOCHEM

Volumn 730, Issue 1-3, 2005, Pages 199-205

DFT explorations of tautomerism of 2-mercaptoimidazole in aqueous solution

(4) Zhu, Hua Jie a Ren, Yi b Ren, Jie a Chu, San Yan c

a INSTITUTE OF GEOLOGY AND GEOPHYSICS (China)

b SICHUAN UNIVERSITY (China)

c NATIONAL TSING HUA UNIVERSITY (Taiwan)

Author keywords

2 Mercaptoimidazole; DFT; Tautomerism; Water assisted proton transfer

Indexed keywords

EID: 26444566373 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/j.theochem.2005.06.023 Document Type: Article

Times cited : (16)

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