Crystal structure of 3-bromo-2-hydroxybenzoic acid

Mutual carboxyl–carboxyl O—H...O hydrogen bonds link the molecules of the title compound, C7H5BrO3, into centrosymmetric dimers which display a central R22(8) ring motif. In addition, there is an intramolecular hydroxyl–carboxyl O—H...O interaction present. A comparison with the crystal structures o...

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Main Authors: Gerhard Laus, Volker Kahlenberg, Thomas Gelbrich, Sven Nerdinger, Herwig Schottenberger
Format: Article
Language:English
Published: International Union of Crystallography 2015-05-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989015007331
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spelling doaj-ef9106b31d1045c781b2f53b2a5cad522020-11-24T20:52:33ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902015-05-0171553153510.1107/S2056989015007331wm5143Crystal structure of 3-bromo-2-hydroxybenzoic acidGerhard Laus0Volker Kahlenberg1Thomas Gelbrich2Sven Nerdinger3Herwig Schottenberger4University of Innsbruck, Faculty of Chemistry and Pharmacy, Innrain 80, 6020 Innsbruck, AustriaUniversity of Innsbruck, Institute of Mineralogy and Petrography, Innrain 52, 6020 Innsbruck, AustriaUniversity of Innsbruck, Faculty of Chemistry and Pharmacy, Innrain 80, 6020 Innsbruck, AustriaSandoz GmbH, Biochemiestrasse 10, 6250 Kundl, AustriaUniversity of Innsbruck, Faculty of Chemistry and Pharmacy, Innrain 80, 6020 Innsbruck, AustriaMutual carboxyl–carboxyl O—H...O hydrogen bonds link the molecules of the title compound, C7H5BrO3, into centrosymmetric dimers which display a central R22(8) ring motif. In addition, there is an intramolecular hydroxyl–carboxyl O—H...O interaction present. A comparison with the crystal structures of 59 other substituted derivatives of salicylic acid shows that both the centrosymmetric carboxyl–carboxyl O—H...O dimer and the stacking mode of molecules along the short a axis observed in the title structure are frequent packing motifs in this set.http://scripts.iucr.org/cgi-bin/paper?S2056989015007331crystal structurehydrogen bondingstructural systematicsXPacsalicylic acid derivative
collection DOAJ
language English
format Article
sources DOAJ
author Gerhard Laus
Volker Kahlenberg
Thomas Gelbrich
Sven Nerdinger
Herwig Schottenberger
spellingShingle Gerhard Laus
Volker Kahlenberg
Thomas Gelbrich
Sven Nerdinger
Herwig Schottenberger
Crystal structure of 3-bromo-2-hydroxybenzoic acid
Acta Crystallographica Section E: Crystallographic Communications
crystal structure
hydrogen bonding
structural systematics
XPac
salicylic acid derivative
author_facet Gerhard Laus
Volker Kahlenberg
Thomas Gelbrich
Sven Nerdinger
Herwig Schottenberger
author_sort Gerhard Laus
title Crystal structure of 3-bromo-2-hydroxybenzoic acid
title_short Crystal structure of 3-bromo-2-hydroxybenzoic acid
title_full Crystal structure of 3-bromo-2-hydroxybenzoic acid
title_fullStr Crystal structure of 3-bromo-2-hydroxybenzoic acid
title_full_unstemmed Crystal structure of 3-bromo-2-hydroxybenzoic acid
title_sort crystal structure of 3-bromo-2-hydroxybenzoic acid
publisher International Union of Crystallography
series Acta Crystallographica Section E: Crystallographic Communications
issn 2056-9890
publishDate 2015-05-01
description Mutual carboxyl–carboxyl O—H...O hydrogen bonds link the molecules of the title compound, C7H5BrO3, into centrosymmetric dimers which display a central R22(8) ring motif. In addition, there is an intramolecular hydroxyl–carboxyl O—H...O interaction present. A comparison with the crystal structures of 59 other substituted derivatives of salicylic acid shows that both the centrosymmetric carboxyl–carboxyl O—H...O dimer and the stacking mode of molecules along the short a axis observed in the title structure are frequent packing motifs in this set.
topic crystal structure
hydrogen bonding
structural systematics
XPac
salicylic acid derivative
url http://scripts.iucr.org/cgi-bin/paper?S2056989015007331
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AT volkerkahlenberg crystalstructureof3bromo2hydroxybenzoicacid
AT thomasgelbrich crystalstructureof3bromo2hydroxybenzoicacid
AT svennerdinger crystalstructureof3bromo2hydroxybenzoicacid
AT herwigschottenberger crystalstructureof3bromo2hydroxybenzoicacid
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