2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride

2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride

In the title compound, C10H14N3+·Cl−, the tetrahydropyridinium ring of the cation, which adopts a slightly distorted envelope conformation, is disordered over two orientations with an occupancy ratio of 0.653 (5):0.347 (5). The amidinium fragmen...

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Main Authors: Krešimir Molčanov, Ivana Stolić, Biserka Kojić-Prodić, Goran Kovačević, Miroslav Bajić
Format: Article
Language:English
Published: International Union of Crystallography 2012-05-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536812014493
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spelling doaj-efb496ce7eb846febc8f5e0735ce8ddd2020-11-25T01:13:22ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-05-01685o1360o136010.1107/S16005368120144932-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chlorideKrešimir MolčanovIvana StolićBiserka Kojić-ProdićGoran KovačevićMiroslav BajićIn the title compound, C10H14N3+·Cl−, the tetrahydropyridinium ring of the cation, which adopts a slightly distorted envelope conformation, is disordered over two orientations with an occupancy ratio of 0.653 (5):0.347 (5). The amidinium fragment of the major conformer is twisted relative to the benzene ring by 22.5 (6)° and the two C—N bond lengths of this fragment are similar [1.3228 (16) and 1.319 (2) Å]. In the crystal, the chloride anions are involved in three N—H...Cl hydrogen bonds, which link the components into a two-dimensional hydrogen-bonded network parallel to (010).http://scripts.iucr.org/cgi-bin/paper?S1600536812014493
collection DOAJ
language English
format Article
sources DOAJ
author Krešimir Molčanov
Ivana Stolić
Biserka Kojić-Prodić
Goran Kovačević
Miroslav Bajić
spellingShingle Krešimir Molčanov
Ivana Stolić
Biserka Kojić-Prodić
Goran Kovačević
Miroslav Bajić
2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride
Acta Crystallographica Section E
author_facet Krešimir Molčanov
Ivana Stolić
Biserka Kojić-Prodić
Goran Kovačević
Miroslav Bajić
author_sort Krešimir Molčanov
title 2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride
title_short 2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride
title_full 2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride
title_fullStr 2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride
title_full_unstemmed 2-(4-Aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride
title_sort 2-(4-aminophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium chloride
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2012-05-01
description In the title compound, C10H14N3+·Cl−, the tetrahydropyridinium ring of the cation, which adopts a slightly distorted envelope conformation, is disordered over two orientations with an occupancy ratio of 0.653 (5):0.347 (5). The amidinium fragment of the major conformer is twisted relative to the benzene ring by 22.5 (6)° and the two C—N bond lengths of this fragment are similar [1.3228 (16) and 1.319 (2) Å]. In the crystal, the chloride anions are involved in three N—H...Cl hydrogen bonds, which link the components into a two-dimensional hydrogen-bonded network parallel to (010).
url http://scripts.iucr.org/cgi-bin/paper?S1600536812014493
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AT ivanastoliamp263 24aminophenyl3456tetrahydropyrimidin1iumchloride
AT biserkakojiamp263prodiamp263 24aminophenyl3456tetrahydropyrimidin1iumchloride
AT gorankovaamp269eviamp263 24aminophenyl3456tetrahydropyrimidin1iumchloride
AT miroslavbajiamp263 24aminophenyl3456tetrahydropyrimidin1iumchloride
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