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Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate
In the crystal of the title molecular salt {systematic name: bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] 2,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolate}, 2C(13)H(11)N(2)O(+)·C(6)Cl(2)O(4) (2−), the chloranilate anion is located on an inversion centre, so that the asymmetric unit co...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2021
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462293/ https://www.ncbi.nlm.nih.gov/pubmed/36337468 http://dx.doi.org/10.1107/S2414314621011500 |
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author | Ishida, Hiroyuki |
author_facet | Ishida, Hiroyuki |
author_sort | Ishida, Hiroyuki |
collection | PubMed |
description | In the crystal of the title molecular salt {systematic name: bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] 2,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolate}, 2C(13)H(11)N(2)O(+)·C(6)Cl(2)O(4) (2−), the chloranilate anion is located on an inversion centre, so that the asymmetric unit contains one cation and one half of the chloranilate anion. In the crystal, the cation and the anion are connected by a bifurcated N—H⋯(O,O) hydrogen bond, forming a 2:1 unit. The units are linked into a layer lying parallel to ( [Image: see text] 01) via O—H⋯O and N—H⋯Cl hydrogen bonds. Between the layers, a C—Cl⋯π interaction is observed. [Image: see text] |
format | Online Article Text |
id | pubmed-9462293 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-94622932022-11-04 Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate Ishida, Hiroyuki IUCrdata Data Reports In the crystal of the title molecular salt {systematic name: bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] 2,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,4-diolate}, 2C(13)H(11)N(2)O(+)·C(6)Cl(2)O(4) (2−), the chloranilate anion is located on an inversion centre, so that the asymmetric unit contains one cation and one half of the chloranilate anion. In the crystal, the cation and the anion are connected by a bifurcated N—H⋯(O,O) hydrogen bond, forming a 2:1 unit. The units are linked into a layer lying parallel to ( [Image: see text] 01) via O—H⋯O and N—H⋯Cl hydrogen bonds. Between the layers, a C—Cl⋯π interaction is observed. [Image: see text] International Union of Crystallography 2021-11-04 /pmc/articles/PMC9462293/ /pubmed/36337468 http://dx.doi.org/10.1107/S2414314621011500 Text en © Hiroyuki Ishida 2021 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 Ishida, Hiroyuki Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate |
title | Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate |
title_full | Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate |
title_fullStr | Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate |
title_full_unstemmed | Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate |
title_short | Bis[2-(2-hydroxyphenyl)-1H-benzimidazol-3-ium] chloranilate |
title_sort | bis[2-(2-hydroxyphenyl)-1h-benzimidazol-3-ium] chloranilate |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462293/ https://www.ncbi.nlm.nih.gov/pubmed/36337468 http://dx.doi.org/10.1107/S2414314621011500 |
work_keys_str_mv | AT ishidahiroyuki bis22hydroxyphenyl1hbenzimidazol3iumchloranilate |