3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione

3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione

In the title compound, C8H6N4O2S, the 1,2,4-triazole ring and the nitro group form dihedral angles of 6.26 (13) and 9.5 (3)°, respectively, with the phenyl ring. In the crystal, the molecules are linked via pairs of N—H...S hydrogen bonds, gener...

Full description

Bibliographic Details
Main Authors: Hoong-Kun Fun, Ching Kheng Quah, Nithinchandra, Balakrishna Kalluraya
Format: Article
Language:English
Published: International Union of Crystallography 2011-09-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811033952
id doaj-0e6aa31d62c74e69ada105ba53da00d2
record_format Article
spelling doaj-0e6aa31d62c74e69ada105ba53da00d22020-11-24T21:25:46ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-09-01679o2413o241310.1107/S16005368110339523-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thioneHoong-Kun FunChing Kheng QuahNithinchandraBalakrishna KallurayaIn the title compound, C8H6N4O2S, the 1,2,4-triazole ring and the nitro group form dihedral angles of 6.26 (13) and 9.5 (3)°, respectively, with the phenyl ring. In the crystal, the molecules are linked via pairs of N—H...S hydrogen bonds, generating [010] chains which contain R22 (8) ring motifs. The crystal structure is further stabilized by π–π stacking [centroid–centroid distance = 3.5491 (14) Å] interactions.http://scripts.iucr.org/cgi-bin/paper?S1600536811033952
collection DOAJ
language English
format Article
sources DOAJ
author Hoong-Kun Fun
Ching Kheng Quah
Nithinchandra
Balakrishna Kalluraya
spellingShingle Hoong-Kun Fun
Ching Kheng Quah
Nithinchandra
Balakrishna Kalluraya
3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione
Acta Crystallographica Section E
author_facet Hoong-Kun Fun
Ching Kheng Quah
Nithinchandra
Balakrishna Kalluraya
author_sort Hoong-Kun Fun
title 3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione
title_short 3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione
title_full 3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione
title_fullStr 3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione
title_full_unstemmed 3-(4-Nitrophenyl)-1H-1,2,4-triazole-5(4H)-thione
title_sort 3-(4-nitrophenyl)-1h-1,2,4-triazole-5(4h)-thione
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2011-09-01
description In the title compound, C8H6N4O2S, the 1,2,4-triazole ring and the nitro group form dihedral angles of 6.26 (13) and 9.5 (3)°, respectively, with the phenyl ring. In the crystal, the molecules are linked via pairs of N—H...S hydrogen bonds, generating [010] chains which contain R22 (8) ring motifs. The crystal structure is further stabilized by π–π stacking [centroid–centroid distance = 3.5491 (14) Å] interactions.
url http://scripts.iucr.org/cgi-bin/paper?S1600536811033952
work_keys_str_mv AT hoongkunfun 34nitrophenyl1h124triazole54hthione
AT chingkhengquah 34nitrophenyl1h124triazole54hthione
AT nithinchandra 34nitrophenyl1h124triazole54hthione
AT balakrishnakalluraya 34nitrophenyl1h124triazole54hthione
_version_ 1725982900633993216

Similar Items