Cargando…

Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide

The title mol­ecule, C(21)H(26)N(2)O(3), adopts a V-shaped conformation and is chiral at the C atom with methyl group attached at the common cut of the edges of the V-conformation and crystallizes as a racemate. It also contains an intra­molecular O—H⋯N hydrogen bond. In the crystal, N—H⋯O hydrogen...

Descripción completa

Detalles Bibliográficos
Autores principales: Mohamed, Shaaban K., Mague, Joel T., Akkurt, Mehmet, Abdel-Rahman, Laila H., Abdel-Hameed, Mohamed, Albayati, Mustafa R., Al-Taif, Elham A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9361381/
https://www.ncbi.nlm.nih.gov/pubmed/35974829
http://dx.doi.org/10.1107/S2056989022007605
_version_ 1784764522380132352
author Mohamed, Shaaban K.
Mague, Joel T.
Akkurt, Mehmet
Abdel-Rahman, Laila H.
Abdel-Hameed, Mohamed
Albayati, Mustafa R.
Al-Taif, Elham A.
author_facet Mohamed, Shaaban K.
Mague, Joel T.
Akkurt, Mehmet
Abdel-Rahman, Laila H.
Abdel-Hameed, Mohamed
Albayati, Mustafa R.
Al-Taif, Elham A.
author_sort Mohamed, Shaaban K.
collection PubMed
description The title mol­ecule, C(21)H(26)N(2)O(3), adopts a V-shaped conformation and is chiral at the C atom with methyl group attached at the common cut of the edges of the V-conformation and crystallizes as a racemate. It also contains an intra­molecular O—H⋯N hydrogen bond. In the crystal, N—H⋯O hydrogen bonds form chains of mol­ecules extending along the c-axis direction, together with normal van der Waals contacts. The roles of the various inter­molecular inter­actions were clarified by Hirshfeld surface analysis, which reveals that the most important contributions to the crystal packing are from H⋯H (62.6%), C⋯H/H⋯C (15.8%) and O⋯H/H⋯O (15.3%) contacts.
format Online
Article
Text
id pubmed-9361381
institution National Center for Biotechnology Information
language English
publishDate 2022
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-93613812022-08-15 Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide Mohamed, Shaaban K. Mague, Joel T. Akkurt, Mehmet Abdel-Rahman, Laila H. Abdel-Hameed, Mohamed Albayati, Mustafa R. Al-Taif, Elham A. Acta Crystallogr E Crystallogr Commun Research Communications The title mol­ecule, C(21)H(26)N(2)O(3), adopts a V-shaped conformation and is chiral at the C atom with methyl group attached at the common cut of the edges of the V-conformation and crystallizes as a racemate. It also contains an intra­molecular O—H⋯N hydrogen bond. In the crystal, N—H⋯O hydrogen bonds form chains of mol­ecules extending along the c-axis direction, together with normal van der Waals contacts. The roles of the various inter­molecular inter­actions were clarified by Hirshfeld surface analysis, which reveals that the most important contributions to the crystal packing are from H⋯H (62.6%), C⋯H/H⋯C (15.8%) and O⋯H/H⋯O (15.3%) contacts. International Union of Crystallography 2022-07-29 /pmc/articles/PMC9361381/ /pubmed/35974829 http://dx.doi.org/10.1107/S2056989022007605 Text en © Mohamed 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
Mohamed, Shaaban K.
Mague, Joel T.
Akkurt, Mehmet
Abdel-Rahman, Laila H.
Abdel-Hameed, Mohamed
Albayati, Mustafa R.
Al-Taif, Elham A.
Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide
title Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide
title_full Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide
title_fullStr Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide
title_full_unstemmed Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide
title_short Crystal structure and Hirshfeld surface analysis of (±)-N′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide
title_sort crystal structure and hirshfeld surface analysis of (±)-n′-(2-hy­droxy-3-meth­oxy­benzyl­idene)-2-(4-iso­butyl­phen­yl)propionohydrazide
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9361381/
https://www.ncbi.nlm.nih.gov/pubmed/35974829
http://dx.doi.org/10.1107/S2056989022007605
work_keys_str_mv AT mohamedshaabank crystalstructureandhirshfeldsurfaceanalysisofn2hydroxy3methoxybenzylidene24isobutylphenylpropionohydrazide
AT maguejoelt crystalstructureandhirshfeldsurfaceanalysisofn2hydroxy3methoxybenzylidene24isobutylphenylpropionohydrazide
AT akkurtmehmet crystalstructureandhirshfeldsurfaceanalysisofn2hydroxy3methoxybenzylidene24isobutylphenylpropionohydrazide
AT abdelrahmanlailah crystalstructureandhirshfeldsurfaceanalysisofn2hydroxy3methoxybenzylidene24isobutylphenylpropionohydrazide
AT abdelhameedmohamed crystalstructureandhirshfeldsurfaceanalysisofn2hydroxy3methoxybenzylidene24isobutylphenylpropionohydrazide
AT albayatimustafar crystalstructureandhirshfeldsurfaceanalysisofn2hydroxy3methoxybenzylidene24isobutylphenylpropionohydrazide
AT altaifelhama crystalstructureandhirshfeldsurfaceanalysisofn2hydroxy3methoxybenzylidene24isobutylphenylpropionohydrazide