Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione

In the title molecule, C17H15ClN4S, the benzene rings form dihedral angles of 16.6 (1) and 77.2 (1)° with the triazole ring. The dihedral angle between the benzene rings is 86.6 (1)°. In the crystal, pairs of N—H...S hydrogen bonds form inversion dimers with graph-set notation R22(8). Weak C—H...S h...

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Main Authors:	Kamni, B. K. Sarojini, P. S. Manjula, B. Narayana, Sumati Anthal, Rajni Kant
Format:	Article
Language:	English
Published:	International Union of Crystallography 2014-09-01
Series:	Acta Crystallographica Section E
Subjects:	crystal structure Schiff base 1,2,4-triazole hydrogen bonding
Online Access:	http://scripts.iucr.org/cgi-bin/paper?S1600536814018352

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spelling	doaj-74bf82b28b6a4313b7541ea64e30e25d2020-11-25T00:21:14ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682014-09-01709o1015o101610.1107/S1600536814018352lh5724Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thioneKamni0B. K. Sarojini1P. S. Manjula2B. Narayana3Sumati Anthal4Rajni Kant5School of Physics, Shri Mata Vaishno Devi University, Katra 182 320, J&K, IndiaDepartment of Chemistry, Mangalore University, Mangalagangotri 574 199, D.K., Mangalore, IndiaDepartment of Chemistry, P A College of Engineering, Nadupadavu 574 153, D.K., Mangalore, IndiaDepartment of Chemistry, Mangalore University, Mangalagangotri 574 199, D.K., Mangalore, IndiaX-ray Crystallography Laboratory, Post-Graduate Department of Physics & Electronics, University of Jammu, Jammu Tawi 180 006, IndiaX-ray Crystallography Laboratory, Post-Graduate Department of Physics & Electronics, University of Jammu, Jammu Tawi 180 006, IndiaIn the title molecule, C17H15ClN4S, the benzene rings form dihedral angles of 16.6 (1) and 77.2 (1)° with the triazole ring. The dihedral angle between the benzene rings is 86.6 (1)°. In the crystal, pairs of N—H...S hydrogen bonds form inversion dimers with graph-set notation R22(8). Weak C—H...S hydrogen bonds link these dimers into layers parallel to (100). Weak intramolecular C—H...S and C—H...N contacts are observed.http://scripts.iucr.org/cgi-bin/paper?S1600536814018352crystal structureSchiff base1,2,4-triazolehydrogen bonding
collection	DOAJ
language	English
format	Article
sources	DOAJ
author	Kamni B. K. Sarojini P. S. Manjula B. Narayana Sumati Anthal Rajni Kant
spellingShingle	Kamni B. K. Sarojini P. S. Manjula B. Narayana Sumati Anthal Rajni Kant Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione Acta Crystallographica Section E crystal structure Schiff base 1,2,4-triazole hydrogen bonding
author_facet	Kamni B. K. Sarojini P. S. Manjula B. Narayana Sumati Anthal Rajni Kant
author_sort	Kamni
title	Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione
title_short	Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione
title_full	Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione
title_fullStr	Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione
title_full_unstemmed	Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione
title_sort	crystal structure of 4-[(e)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1h-1,2,4-triazole-5(4h)-thione
publisher	International Union of Crystallography
series	Acta Crystallographica Section E
issn	1600-5368
publishDate	2014-09-01
description	In the title molecule, C17H15ClN4S, the benzene rings form dihedral angles of 16.6 (1) and 77.2 (1)° with the triazole ring. The dihedral angle between the benzene rings is 86.6 (1)°. In the crystal, pairs of N—H...S hydrogen bonds form inversion dimers with graph-set notation R22(8). Weak C—H...S hydrogen bonds link these dimers into layers parallel to (100). Weak intramolecular C—H...S and C—H...N contacts are observed.
topic	crystal structure Schiff base 1,2,4-triazole hydrogen bonding
url	http://scripts.iucr.org/cgi-bin/paper?S1600536814018352
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Crystal structure of 4-[(E)-(4-chlorobenzylidene)amino]-3-(2-methylbenzyl)-1H-1,2,4-triazole-5(4H)-thione

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