Crystal structure of ethyl 6-(2-fluorophenyl)-4-hydroxy-2-sulfanylidene-4- trifluoromethy1-1,3-diazinane-5-carboxy late

被引:2
|
作者
Krishnamurthy, M. S. [1 ]
Begum, Noor Shahina [1 ]
机构
[1] Bangalore Univ, Dept Studies Chem, Cent Coll Campus, Bangalore 560001, Karnataka, India
关键词
crystal structure; dihydropyrimidine derivative; organofluorine compounds; hydrogen bonding;
D O I
10.1107/S2056989015005836
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
In the title compound, C4H14F4N2O3S, the central dihydropyrimidine ring adopts a sofa conformation with the C atom bearing the 2-fluorobenzene ring displaced by 0.596 (3) angstrom from the other five atoms. The 2-fluorobenzene ring is positioned axially and bisects the pyrimidine ring with a dihedral angle of 70.92 (8)degrees. The molecular conformation is stabilized by an intramolecular O-H center dot center dot center dot O hydrogen bond, generating an S(6) ring. The crystal structure features C-H center dot center dot center dot F, N-H center dot center dot center dot S and N-H center dot center dot center dot O hydrogen bonds, which link the molecules into a three-dimensional network.
引用
收藏
页码:O268 / U206
页数:11
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