6-Bromo-1,3-benzothia­zol-2-amine

The r.m.s. deviation from the mean plane for the non-H atoms in the title compound, C(7)H(5)BrN(2)S, is 0.011 Å. In the crystal, the mol­ecules are linked by N—H⋯N and N—H⋯Br hydrogen bonds to generate (010) sheets. Weak aromatic π–π stacking [centroid-to-centroid separation = 3.884 (10) Å] and poss...

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Autores principales: Gao, Xing-Jun, Jin, Shou-Wen, Huang, Yan-Fei, Zhou, Yong, Zhou, Ying-Ping
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470373/
https://www.ncbi.nlm.nih.gov/pubmed/23125786
http://dx.doi.org/10.1107/S1600536812040123
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author Gao, Xing-Jun
Jin, Shou-Wen
Huang, Yan-Fei
Zhou, Yong
Zhou, Ying-Ping
author_facet Gao, Xing-Jun
Jin, Shou-Wen
Huang, Yan-Fei
Zhou, Yong
Zhou, Ying-Ping
author_sort Gao, Xing-Jun
collection PubMed
description The r.m.s. deviation from the mean plane for the non-H atoms in the title compound, C(7)H(5)BrN(2)S, is 0.011 Å. In the crystal, the mol­ecules are linked by N—H⋯N and N—H⋯Br hydrogen bonds to generate (010) sheets. Weak aromatic π–π stacking [centroid-to-centroid separation = 3.884 (10) Å] and possible C—H⋯Br inter­actions are also observed. The crystal studied was found to be an inversion twin.
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spelling pubmed-34703732012-11-02 6-Bromo-1,3-benzothia­zol-2-amine Gao, Xing-Jun Jin, Shou-Wen Huang, Yan-Fei Zhou, Yong Zhou, Ying-Ping Acta Crystallogr Sect E Struct Rep Online Organic Papers The r.m.s. deviation from the mean plane for the non-H atoms in the title compound, C(7)H(5)BrN(2)S, is 0.011 Å. In the crystal, the mol­ecules are linked by N—H⋯N and N—H⋯Br hydrogen bonds to generate (010) sheets. Weak aromatic π–π stacking [centroid-to-centroid separation = 3.884 (10) Å] and possible C—H⋯Br inter­actions are also observed. The crystal studied was found to be an inversion twin. International Union of Crystallography 2012-09-26 /pmc/articles/PMC3470373/ /pubmed/23125786 http://dx.doi.org/10.1107/S1600536812040123 Text en © Gao et al. 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Gao, Xing-Jun
Jin, Shou-Wen
Huang, Yan-Fei
Zhou, Yong
Zhou, Ying-Ping
6-Bromo-1,3-benzothia­zol-2-amine
title 6-Bromo-1,3-benzothia­zol-2-amine
title_full 6-Bromo-1,3-benzothia­zol-2-amine
title_fullStr 6-Bromo-1,3-benzothia­zol-2-amine
title_full_unstemmed 6-Bromo-1,3-benzothia­zol-2-amine
title_short 6-Bromo-1,3-benzothia­zol-2-amine
title_sort 6-bromo-1,3-benzothia­zol-2-amine
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470373/
https://www.ncbi.nlm.nih.gov/pubmed/23125786
http://dx.doi.org/10.1107/S1600536812040123
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AT huangyanfei 6bromo13benzothiazol2amine
AT zhouyong 6bromo13benzothiazol2amine
AT zhouyingping 6bromo13benzothiazol2amine

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