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4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid

In the title compound, C(10)H(9)N(3)O(3), there is a small twist between the benzene and triazole rings [dihedral angle = 6.32 (7)°]; the carb­oxy­lic acid residue is almost coplanar with the benzene ring to which it is attached [O—C—C—C torsion angle = 1.49 (19)°]. The main deviation from coplanari...

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Autores principales: Ishak, Dayang Hazwani Abang, Tajuddin, Hairul Anuar, Abdullah, Zanariah, Abd Halim, Siti Nadiah, Tiekink, Edward R. T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3151797/
https://www.ncbi.nlm.nih.gov/pubmed/21837058
http://dx.doi.org/10.1107/S1600536811022409
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author Ishak, Dayang Hazwani Abang
Tajuddin, Hairul Anuar
Abdullah, Zanariah
Abd Halim, Siti Nadiah
Tiekink, Edward R. T.
author_facet Ishak, Dayang Hazwani Abang
Tajuddin, Hairul Anuar
Abdullah, Zanariah
Abd Halim, Siti Nadiah
Tiekink, Edward R. T.
author_sort Ishak, Dayang Hazwani Abang
collection PubMed
description In the title compound, C(10)H(9)N(3)O(3), there is a small twist between the benzene and triazole rings [dihedral angle = 6.32 (7)°]; the carb­oxy­lic acid residue is almost coplanar with the benzene ring to which it is attached [O—C—C—C torsion angle = 1.49 (19)°]. The main deviation from coplanarity of the non-H atoms is found for the hy­droxy group which is almost perpendicular to the remaining atoms [N—C—C—O torsion angle = −75.46 (16)°]. In the crystal, the presence of O—H⋯O (between carboxyl groups) and O—H⋯N (between the hy­droxy group and the triazole ring) hydrogen bonds leads to supra­molecular chains along [03[Image: see text]]. The chains are connected into sheets via C—H⋯O(hy­droxy) inter­actions.
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spelling pubmed-31517972011-08-11 4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid Ishak, Dayang Hazwani Abang Tajuddin, Hairul Anuar Abdullah, Zanariah Abd Halim, Siti Nadiah Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(10)H(9)N(3)O(3), there is a small twist between the benzene and triazole rings [dihedral angle = 6.32 (7)°]; the carb­oxy­lic acid residue is almost coplanar with the benzene ring to which it is attached [O—C—C—C torsion angle = 1.49 (19)°]. The main deviation from coplanarity of the non-H atoms is found for the hy­droxy group which is almost perpendicular to the remaining atoms [N—C—C—O torsion angle = −75.46 (16)°]. In the crystal, the presence of O—H⋯O (between carboxyl groups) and O—H⋯N (between the hy­droxy group and the triazole ring) hydrogen bonds leads to supra­molecular chains along [03[Image: see text]]. The chains are connected into sheets via C—H⋯O(hy­droxy) inter­actions. International Union of Crystallography 2011-06-18 /pmc/articles/PMC3151797/ /pubmed/21837058 http://dx.doi.org/10.1107/S1600536811022409 Text en © Ishak et al. 2011 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
Ishak, Dayang Hazwani Abang
Tajuddin, Hairul Anuar
Abdullah, Zanariah
Abd Halim, Siti Nadiah
Tiekink, Edward R. T.
4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid
title 4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid
title_full 4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid
title_fullStr 4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid
title_full_unstemmed 4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid
title_short 4-(4-Hy­droxy­methyl-1H-1,2,3-triazol-1-yl)benzoic acid
title_sort 4-(4-hy­droxy­methyl-1h-1,2,3-triazol-1-yl)benzoic acid
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3151797/
https://www.ncbi.nlm.nih.gov/pubmed/21837058
http://dx.doi.org/10.1107/S1600536811022409
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