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Magnetic Resonance in Chemistry

Volumn 50, Issue 2, 2012, Pages 106-113

Density functional theory study of 13C NMR chemical shift of chlorinated compounds

(4) Li, Songqing a Zhou, Wenfeng a Gao, Haixiang a Zhou, Zhiqiang a

a CHINA AGRICULTURAL UNIVERSITY (China)

Author keywords

accurate predictions; chlorinated compounds; NMR; WC04 functional

Indexed keywords

CHLORINE COMPOUNDS; DENSITY FUNCTIONAL THEORY; FORECASTING; ORGANIC COMPOUNDS; SOLVENTS;

ACCURATE PREDICTION; CHLORINATED COMPOUNDS; CHLORINATED ORGANIC COMPOUNDS; DENSITY FUNCTIONAL THEORY STUDIES; DENSITY-FUNCTIONAL-THEORY; FUNCTIONALS; NMR CHEMICAL SHIFTS; PARAMAGNETIC CONTRIBUTION; PERFORMANCE; WC04 FUNCTIONAL;

CHEMICAL SHIFT;

EID: 84862804219 PISSN: 07491581 EISSN: 1097458X Source Type: Journal
DOI: 10.1002/mrc.2837 Document Type: Article

Times cited : (13)

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