2-Methyl-2-(3-nitrophenyl)-1,3-dithiane

被引:0
|
作者
Mirosova, Pavla [1 ]
Necas, Marek [2 ]
Vicha, Robert [1 ]
机构
[1] Tomas Bata Univ Zlin, Fac Technol, Dept Chem, TG Masaryka 275, Zlin 76272, Czech Republic
[2] Masaryk Univ, Fac Sci, Dept Chem, Brno 62500, Czech Republic
关键词
D O I
10.1107/S1600536812022283
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The title compound, C11H13NO2S2, contains a 1,3-dithiane ring in an almost ideal chair conformation with the following puckering parameters: Q= 0.7252 (15) angstrom, theta = 6.71 (13) and phi = 50.4 (11)degrees The benzene ring occupies an axial position at the dithiane ring. The nitro group is almost coplanar with the benzene ring [O-N-C-C = -3.2 (2)degrees]. The molecule has an L-shape with a C-C-C-C torsion angle of -74.15 (17)degrees for the atoms of the methyl group and the dithiane-benzene linkage. The crystal packing is stabilized only via weak nonspecific van der Waals interactions.
引用
收藏
页码:O1827 / +
页数:6
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