2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate

The title hydrated salt, C(21)H(17)N(2)O(3) (+)·Cl(−)·H(2)O, exhibits disorder in one of the furan rings. The major and minor components have a refined occupancy ratio of 0.844 (19):0.156 (19). The structure displays intermolecular hydrogen bonding involving the water molecule and the chloride anion...

Descripción completa

Detalles Bibliográficos
Autores principales: Geiger, David K., Geiger, H. Cristina, Deck, Jared M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470365/
https://www.ncbi.nlm.nih.gov/pubmed/23125778
http://dx.doi.org/10.1107/S1600536812040135
_version_ 1782246262274260992
author Geiger, David K.
Geiger, H. Cristina
Deck, Jared M.
author_facet Geiger, David K.
Geiger, H. Cristina
Deck, Jared M.
author_sort Geiger, David K.
collection PubMed
description The title hydrated salt, C(21)H(17)N(2)O(3) (+)·Cl(−)·H(2)O, exhibits disorder in one of the furan rings. The major and minor components have a refined occupancy ratio of 0.844 (19):0.156 (19). The structure displays intermolecular hydrogen bonding involving the water molecule and the chloride anion. Close intermolecular C—H⋯Cl and C—H⋯(furan ring) inter­actions complete the hydrogen bonding.
format Online
Article
Text
id pubmed-3470365
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-34703652012-11-02 2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate Geiger, David K. Geiger, H. Cristina Deck, Jared M. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title hydrated salt, C(21)H(17)N(2)O(3) (+)·Cl(−)·H(2)O, exhibits disorder in one of the furan rings. The major and minor components have a refined occupancy ratio of 0.844 (19):0.156 (19). The structure displays intermolecular hydrogen bonding involving the water molecule and the chloride anion. Close intermolecular C—H⋯Cl and C—H⋯(furan ring) inter­actions complete the hydrogen bonding. International Union of Crystallography 2012-09-26 /pmc/articles/PMC3470365/ /pubmed/23125778 http://dx.doi.org/10.1107/S1600536812040135 Text en © Geiger et al. 2012 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
Geiger, David K.
Geiger, H. Cristina
Deck, Jared M.
2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate
title 2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate
title_full 2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate
title_fullStr 2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate
title_full_unstemmed 2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate
title_short 2-(Furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1H-benzimidazol-3-ium chloride monohydrate
title_sort 2-(furan-2-yl)-1,3-bis(furan-2-ylmeth­yl)-1h-benzimidazol-3-ium chloride monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3470365/
https://www.ncbi.nlm.nih.gov/pubmed/23125778
http://dx.doi.org/10.1107/S1600536812040135
work_keys_str_mv AT geigerdavidk 2furan2yl13bisfuran2ylmethyl1hbenzimidazol3iumchloridemonohydrate
AT geigerhcristina 2furan2yl13bisfuran2ylmethyl1hbenzimidazol3iumchloridemonohydrate
AT deckjaredm 2furan2yl13bisfuran2ylmethyl1hbenzimidazol3iumchloridemonohydrate

Ejemplares similares