2-Carboxyanilinium chloride monohydrate

In the molecule of the title compound, C7H8NO2+·Cl−·H2O, an intramolecular N—H...O hydrogen bond results in the formation of a non-planar six-membered ring adopting a flattened boat conformation. In the crystal structure, intermolecular O—H...O and N&a...

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Main Authors: Muhammad Ashraf Chaudhary, Javed Iqbal, M. Nawaz Tahir, Syed Azeem Rashid Ali Zaidi
Format: Article
Language:English
Published: International Union of Crystallography 2008-10-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536808029267
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spelling doaj-ebba9a655102481899b897d1c000d0b72020-11-24T23:54:39ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682008-10-016410o1957o195710.1107/S16005368080292672-Carboxyanilinium chloride monohydrateMuhammad Ashraf ChaudharyJaved IqbalM. Nawaz TahirSyed Azeem Rashid Ali ZaidiIn the molecule of the title compound, C7H8NO2+·Cl−·H2O, an intramolecular N—H...O hydrogen bond results in the formation of a non-planar six-membered ring adopting a flattened boat conformation. In the crystal structure, intermolecular O—H...O and N—H...Cl hydrogen bonds link the molecules. There is a C=O...π contact between the carbonyl unit and the centroid of the benzene ring. There is a C=O...π contact [C...Cg = 3.5802 (18), C—O...Cg = 89 (1)°] between the carbonyl unit and the centroid of the benzene ring.http://scripts.iucr.org/cgi-bin/paper?S1600536808029267
collection DOAJ
language English
format Article
sources DOAJ
author Muhammad Ashraf Chaudhary
Javed Iqbal
M. Nawaz Tahir
Syed Azeem Rashid Ali Zaidi
spellingShingle Muhammad Ashraf Chaudhary
Javed Iqbal
M. Nawaz Tahir
Syed Azeem Rashid Ali Zaidi
2-Carboxyanilinium chloride monohydrate
Acta Crystallographica Section E
author_facet Muhammad Ashraf Chaudhary
Javed Iqbal
M. Nawaz Tahir
Syed Azeem Rashid Ali Zaidi
author_sort Muhammad Ashraf Chaudhary
title 2-Carboxyanilinium chloride monohydrate
title_short 2-Carboxyanilinium chloride monohydrate
title_full 2-Carboxyanilinium chloride monohydrate
title_fullStr 2-Carboxyanilinium chloride monohydrate
title_full_unstemmed 2-Carboxyanilinium chloride monohydrate
title_sort 2-carboxyanilinium chloride monohydrate
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2008-10-01
description In the molecule of the title compound, C7H8NO2+·Cl−·H2O, an intramolecular N—H...O hydrogen bond results in the formation of a non-planar six-membered ring adopting a flattened boat conformation. In the crystal structure, intermolecular O—H...O and N—H...Cl hydrogen bonds link the molecules. There is a C=O...π contact between the carbonyl unit and the centroid of the benzene ring. There is a C=O...π contact [C...Cg = 3.5802 (18), C—O...Cg = 89 (1)°] between the carbonyl unit and the centroid of the benzene ring.
url http://scripts.iucr.org/cgi-bin/paper?S1600536808029267
work_keys_str_mv AT muhammadashrafchaudhary 2carboxyaniliniumchloridemonohydrate
AT javediqbal 2carboxyaniliniumchloridemonohydrate
AT mnawaztahir 2carboxyaniliniumchloridemonohydrate
AT syedazeemrashidalizaidi 2carboxyaniliniumchloridemonohydrate
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