3-(Adamantan-1-yl)-1-[(4-ethylpiperazin-1-yl) methyl]-4-[(E)-(4-hydroxybenzylidene)amino]-1H-1,2,4-triazole-5(4H)-thione

被引：6
作者：
El-Emam, Ali A. [1 ]
Alrashood, Khalid A. [1 ]
Al-Tamimi, Abdul-Malek S. [1 ]
Ng, Seik Weng [2 ,3 ]
Tiekink, Edward R. T. [2 ]
机构：
[1] King Saud Univ, Coll Pharm, Dept Pharmaceut Chem, Riyadh 11451, Saudi Arabia
[2] Univ Malaya, Dept Chem, Kuala Lumpur 50603, Malaysia
[3] King Abdulaziz Univ, Fac Sci, Dept Chem, Jeddah, Saudi Arabia
来源：
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2012年 / 68卷
关键词：
data-to-parameter ratio = 15.5; mean σ(C-C) = 0.004 Å; R factor = 0.039; single-crystal X-ray study; T = 100 K; wR factor = 0.100;
D O I：
10.1107/S1600536812005107
中图分类号：
O7 [晶体学];
学科分类号：
0702 ; 070205 ; 0703 ; 080501 ;
摘要：
In the title thione, C 26H 36N 6OS, the 1,2,4-triazole ring is planar (r.m.s. deviation = 0.020 Å) and the benzene ring is twisted out of this plane [dihedral angle = 62.35 (12)°]. Supra-molecular zigzag chains feature in the crystal packing. These are sustained by O - H⋯N(piperazine) hydrogen bonds, and are connected into the three-dimensional crystal structure by C - H⋯S and C - H⋯O interactions. The crystal studied was a racemic twin.
引用
收藏
页码：O657 / U1783
页数：12
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