Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate

In the title compound, C(18)H(15)ClN(3)O(+)·Cl(−)·2H(2)O, three intra­mol­ecular hydrogen bonds are observed, N—H⋯O, O—H⋯Cl and O—H⋯O. In the crystal, mol­ecules are connected by C—H⋯Cl and N—H⋯O hydrogen bonds. Strong C—H⋯Cl, N—H⋯O, O—H⋯Cl and O—H⋯O hydrogen-bonding inter­actions are implied by the...

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Autores principales: Daoui, Said, Çınar, Emine Berrin, Dege, Necmi, Benchat, Noureddine, Saif, Eiad, Karrouchi, Khalid
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8983968/
https://www.ncbi.nlm.nih.gov/pubmed/35492268
http://dx.doi.org/10.1107/S2056989022003346
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author Daoui, Said
Çınar, Emine Berrin
Dege, Necmi
Benchat, Noureddine
Saif, Eiad
Karrouchi, Khalid
author_facet Daoui, Said
Çınar, Emine Berrin
Dege, Necmi
Benchat, Noureddine
Saif, Eiad
Karrouchi, Khalid
author_sort Daoui, Said
collection PubMed
description In the title compound, C(18)H(15)ClN(3)O(+)·Cl(−)·2H(2)O, three intra­mol­ecular hydrogen bonds are observed, N—H⋯O, O—H⋯Cl and O—H⋯O. In the crystal, mol­ecules are connected by C—H⋯Cl and N—H⋯O hydrogen bonds. Strong C—H⋯Cl, N—H⋯O, O—H⋯Cl and O—H⋯O hydrogen-bonding inter­actions are implied by the Hirshfeld surface analysis, which indicate that H⋯H contacts make the largest contribution to the overall crystal packing at 33.0%.
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spelling pubmed-89839682022-04-28 Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate Daoui, Said Çınar, Emine Berrin Dege, Necmi Benchat, Noureddine Saif, Eiad Karrouchi, Khalid Acta Crystallogr E Crystallogr Commun Research Communications In the title compound, C(18)H(15)ClN(3)O(+)·Cl(−)·2H(2)O, three intra­mol­ecular hydrogen bonds are observed, N—H⋯O, O—H⋯Cl and O—H⋯O. In the crystal, mol­ecules are connected by C—H⋯Cl and N—H⋯O hydrogen bonds. Strong C—H⋯Cl, N—H⋯O, O—H⋯Cl and O—H⋯O hydrogen-bonding inter­actions are implied by the Hirshfeld surface analysis, which indicate that H⋯H contacts make the largest contribution to the overall crystal packing at 33.0%. International Union of Crystallography 2022-03-31 /pmc/articles/PMC8983968/ /pubmed/35492268 http://dx.doi.org/10.1107/S2056989022003346 Text en © Daoui et al. 2022 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 Research Communications
Daoui, Said
Çınar, Emine Berrin
Dege, Necmi
Benchat, Noureddine
Saif, Eiad
Karrouchi, Khalid
Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate
title Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate
title_full Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate
title_fullStr Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate
title_full_unstemmed Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate
title_short Crystal structure of (E)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate
title_sort crystal structure of (e)-3-({6-[2-(4-chloro­phen­yl)ethen­yl]-3-oxo-2,3-di­hydro­pyridazin-4-yl}meth­yl)pyridin-1-ium chloride dihydrate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8983968/
https://www.ncbi.nlm.nih.gov/pubmed/35492268
http://dx.doi.org/10.1107/S2056989022003346
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