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1-Benzyl-3-methylimidazolium bromide
The title compound, (BenzMIm)Br (BenzMIm=1-benzyl-3-methylimidazolium), C(11)H(13)N(2) (+)·Br(−), was obtained as single crystals directly from a pure and liquid sample of the compound over several weeks. The molecular structure of (BenzMIm)Br consists of separated bromide anions and 1-benzyl-3-...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462234/ https://www.ncbi.nlm.nih.gov/pubmed/36340612 http://dx.doi.org/10.1107/S2414314620007683 |
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author | Peppel, Tim Wulf, Christoph Spannenberg, Anke |
author_facet | Peppel, Tim Wulf, Christoph Spannenberg, Anke |
author_sort | Peppel, Tim |
collection | PubMed |
description | The title compound, (BenzMIm)Br (BenzMIm=1-benzyl-3-methylimidazolium), C(11)H(13)N(2) (+)·Br(−), was obtained as single crystals directly from a pure and liquid sample of the compound over several weeks. The molecular structure of (BenzMIm)Br consists of separated bromide anions and 1-benzyl-3-methylimidazolium cations connected via short C—H⋯Br contacts. The compound exhibits a relatively low melting point (m.p. = 72°C) and is a supercooled, highly viscous transparent liquid at ambient conditions. The title compound crystallizes with two unique ion pairs in the asymmetric unit of the orthorhombic unit cell. [Image: see text] |
format | Online Article Text |
id | pubmed-9462234 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2020 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-94622342022-11-04 1-Benzyl-3-methylimidazolium bromide Peppel, Tim Wulf, Christoph Spannenberg, Anke IUCrdata Data Reports The title compound, (BenzMIm)Br (BenzMIm=1-benzyl-3-methylimidazolium), C(11)H(13)N(2) (+)·Br(−), was obtained as single crystals directly from a pure and liquid sample of the compound over several weeks. The molecular structure of (BenzMIm)Br consists of separated bromide anions and 1-benzyl-3-methylimidazolium cations connected via short C—H⋯Br contacts. The compound exhibits a relatively low melting point (m.p. = 72°C) and is a supercooled, highly viscous transparent liquid at ambient conditions. The title compound crystallizes with two unique ion pairs in the asymmetric unit of the orthorhombic unit cell. [Image: see text] International Union of Crystallography 2020-06-09 /pmc/articles/PMC9462234/ /pubmed/36340612 http://dx.doi.org/10.1107/S2414314620007683 Text en © Peppel et al. 2020 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Data Reports Peppel, Tim Wulf, Christoph Spannenberg, Anke 1-Benzyl-3-methylimidazolium bromide |
title | 1-Benzyl-3-methylimidazolium bromide |
title_full | 1-Benzyl-3-methylimidazolium bromide |
title_fullStr | 1-Benzyl-3-methylimidazolium bromide |
title_full_unstemmed | 1-Benzyl-3-methylimidazolium bromide |
title_short | 1-Benzyl-3-methylimidazolium bromide |
title_sort | 1-benzyl-3-methylimidazolium bromide |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462234/ https://www.ncbi.nlm.nih.gov/pubmed/36340612 http://dx.doi.org/10.1107/S2414314620007683 |
work_keys_str_mv | AT peppeltim 1benzyl3methylimidazoliumbromide AT wulfchristoph 1benzyl3methylimidazoliumbromide AT spannenberganke 1benzyl3methylimidazoliumbromide |