Crystal structure of 4-{[(1H-1,2,4-triazol-1-yl)methyl]sulfanyl}phenol

被引:0
作者
Zhang, Yong-Le [1 ]
Zhang, Chuang [1 ]
Guo, Wei [1 ]
Wang, Jing [1 ]
机构
[1] Hebei Med Univ, Sch Pharmaceut Sci, Shijiazhuang 050017, Hebei, Peoples R China
关键词
crystal structure; 1,2,4-triazole derivative; hydrogen bonding; pi-pi stacking; biological activity;
D O I
10.1107/S1600536814019965
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
In the title compound, C9H9N3OS, the plane of the benzene ring forms a dihedral angle of 33.40 (5) degrees with that of the triazole group. In the crystal, molecules are linked by O-H center dot center dot center dot N hydrogen bonds involving the phenol -OH group and one of the unsubstituted N atoms of the triazole ring, resulting in chains along [010]. These chains are further extended into a layer parallel to (001) by weak C-H center dot center dot center dot N hydrogen-bond interactions. Aromatic pi- pi stacking [centroid-centroid separation = 3.556 (1) angstrom] between the triazole rings links the layers into a three-dimensional network.
引用
收藏
页码:O1106 / +
页数:6
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