Comparison of epimeric methyl lithocholate and methyl iso-lithocholate molecules:: Single crystal X-ray structure of methyl lithocholate, ab initio HF/6-31G* optimized structures and experimental and calculated DFT/B3LYP 13C NMR chemical shifts (vol 649, pg 207, 2003)

被引:1
作者
Virtanen, E [1 ]
Nissinen, M [1 ]
Suontamo, R [1 ]
Tammine, J [1 ]
Kolehmainen, E [1 ]
机构
[1] Univ Jyvaskyla, Dept Chem, Jyvaskyla 40014, Finland
关键词
D O I
10.1016/S0022-2860(03)00499-X
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:405 / 406
页数:2
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[1]   Comparison of epimeric methyl lithocholate and methyl iso-lithocholate molecules:: single crystal X-ray structure of methyl lithocholate, ab initio HF/6-31G*optimized structures and experimental and calculated DFT/B3LYP 13C NMR chemical shifts [J].
Virtanen, E ;
Nissinen, M ;
Suontamo, R ;
Tamminen, J ;
Kolehmainen, E .
JOURNAL OF MOLECULAR STRUCTURE, 2003, 649 (03) :207-218