4-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thione
The title compound, C11H11ClN4OS, crystallizes with two molecules, A and B, in the asymmetric unit in which the dihedral angles between the triazole and benzene rings are 54.6 (3) and 56.0 (3)°. Both molecules feature an intramolecular O—H...N hydrogen bond, which generates an S(6) ring. In the crys...
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International Union of Crystallography
2014-05-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536814008320 |
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doaj-862a8e4d1f6242b597819ff8dbee7cd82020-11-25T00:21:14ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682014-05-01705o574o57510.1107/S1600536814008320hb72054-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thioneCai-Xia Yuan0Xu-Mei Yao1Miao-Li Zhu2Hong-Mei Zhu3Institute of Molecular Science, Key Laboratory of Chemical Biology and Molecular Engineering of the Education Ministry, Shanxi University, Taiyuan, Shanxi 030006, People's Republic of ChinaInstitute of Molecular Science, Key Laboratory of Chemical Biology and Molecular Engineering of the Education Ministry, Shanxi University, Taiyuan, Shanxi 030006, People's Republic of ChinaInstitute of Molecular Science, Key Laboratory of Chemical Biology and Molecular Engineering of the Education Ministry, Shanxi University, Taiyuan, Shanxi 030006, People's Republic of ChinaCollege of Chemistry & Chemical Engineering, Shanxi University, Taiyuan, Shanxi 030006, People's Republic of ChinaThe title compound, C11H11ClN4OS, crystallizes with two molecules, A and B, in the asymmetric unit in which the dihedral angles between the triazole and benzene rings are 54.6 (3) and 56.0 (3)°. Both molecules feature an intramolecular O—H...N hydrogen bond, which generates an S(6) ring. In the crystal, A–B dimers are linked by pairs of weak C—H...S hydrogen bonds along with π–π stacking interactions between the triazole rings [centroid–centroid separations = 3.631 (3) and 3.981 (4)Å]. N—H...S hydrogen bonds link the dimers into [100] chains, which feature R22(8) loops.http://scripts.iucr.org/cgi-bin/paper?S1600536814008320 |
| collection |
DOAJ |
| language |
English |
| format |
Article |
| sources |
DOAJ |
| author |
Cai-Xia Yuan Xu-Mei Yao Miao-Li Zhu Hong-Mei Zhu |
| spellingShingle |
Cai-Xia Yuan Xu-Mei Yao Miao-Li Zhu Hong-Mei Zhu 4-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thione Acta Crystallographica Section E |
| author_facet |
Cai-Xia Yuan Xu-Mei Yao Miao-Li Zhu Hong-Mei Zhu |
| author_sort |
Cai-Xia Yuan |
| title |
4-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_short |
4-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_full |
4-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_fullStr |
4-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_full_unstemmed |
4-[(5-Chloro-2-hydroxybenzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_sort |
4-[(5-chloro-2-hydroxybenzylidene)amino]-3-ethyl-1h-1,2,4-triazole-5(4h)-thione |
| publisher |
International Union of Crystallography |
| series |
Acta Crystallographica Section E |
| issn |
1600-5368 |
| publishDate |
2014-05-01 |
| description |
The title compound, C11H11ClN4OS, crystallizes with two molecules, A and B, in the asymmetric unit in which the dihedral angles between the triazole and benzene rings are 54.6 (3) and 56.0 (3)°. Both molecules feature an intramolecular O—H...N hydrogen bond, which generates an S(6) ring. In the crystal, A–B dimers are linked by pairs of weak C—H...S hydrogen bonds along with π–π stacking interactions between the triazole rings [centroid–centroid separations = 3.631 (3) and 3.981 (4)Å]. N—H...S hydrogen bonds link the dimers into [100] chains, which feature R22(8) loops. |
| url |
http://scripts.iucr.org/cgi-bin/paper?S1600536814008320 |
| work_keys_str_mv |
AT caixiayuan 45chloro2hydroxybenzylideneamino3ethyl1h124triazole54hthione AT xumeiyao 45chloro2hydroxybenzylideneamino3ethyl1h124triazole54hthione AT miaolizhu 45chloro2hydroxybenzylideneamino3ethyl1h124triazole54hthione AT hongmeizhu 45chloro2hydroxybenzylideneamino3ethyl1h124triazole54hthione |
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