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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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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2008
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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. |
format | Text |
id | pubmed-2962110 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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 |
work_keys_str_mv | AT samardjievivan 26diisopropylaniliniumchloride AT samasbrian 26diisopropylaniliniumchloride |