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2,6-Diisopropyl­anilinium chloride

The title compound, C(12)H(20)N(+)·Cl(−), crystallizes with the chloride anions situated on twofold axes, while the cation is on a general position. All conventional hydrogen-bond donors and acceptors are utilized, forming a hydrogen-bonded ladder motif along the c axis. Investigation of the torsion...

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Detalles Bibliográficos
Autores principales: Samardjiev, Ivan, Samas, Brian
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2962110/
https://www.ncbi.nlm.nih.gov/pubmed/21203192
http://dx.doi.org/10.1107/S160053680801790X
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author Samardjiev, Ivan
Samas, Brian
author_facet Samardjiev, Ivan
Samas, Brian
author_sort Samardjiev, Ivan
collection PubMed
description The title compound, C(12)H(20)N(+)·Cl(−), crystallizes with the chloride anions situated on twofold axes, while the cation is on a general position. All conventional hydrogen-bond donors and acceptors are utilized, forming a hydrogen-bonded ladder motif along the c axis. Investigation of the torsion angles between aromatic systems and isopropyl groups reveals unusual geometrical features. One isopropyl groups exhibits an expected eclipsed conformation with respect to the aromatic ring. The other isopropyl group shows a slight twist with respect to the aromatic ring. The short Cl⋯HC(methine) contact (2.88 Å) observed in the asymmetric unit is the probable reason for the twist feature around the isopropyl area.
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spelling pubmed-29621102010-12-30 2,6-Diisopropyl­anilinium chloride Samardjiev, Ivan Samas, Brian Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(12)H(20)N(+)·Cl(−), crystallizes with the chloride anions situated on twofold axes, while the cation is on a general position. All conventional hydrogen-bond donors and acceptors are utilized, forming a hydrogen-bonded ladder motif along the c axis. Investigation of the torsion angles between aromatic systems and isopropyl groups reveals unusual geometrical features. One isopropyl groups exhibits an expected eclipsed conformation with respect to the aromatic ring. The other isopropyl group shows a slight twist with respect to the aromatic ring. The short Cl⋯HC(methine) contact (2.88 Å) observed in the asymmetric unit is the probable reason for the twist feature around the isopropyl area. International Union of Crystallography 2008-07-12 /pmc/articles/PMC2962110/ /pubmed/21203192 http://dx.doi.org/10.1107/S160053680801790X Text en © Samardjiev and Samas 2008 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
Samardjiev, Ivan
Samas, Brian
2,6-Diisopropyl­anilinium chloride
title 2,6-Diisopropyl­anilinium chloride
title_full 2,6-Diisopropyl­anilinium chloride
title_fullStr 2,6-Diisopropyl­anilinium chloride
title_full_unstemmed 2,6-Diisopropyl­anilinium chloride
title_short 2,6-Diisopropyl­anilinium chloride
title_sort 2,6-diisopropyl­anilinium chloride
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2962110/
https://www.ncbi.nlm.nih.gov/pubmed/21203192
http://dx.doi.org/10.1107/S160053680801790X
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