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Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate

The asymmetric unit of the title compound, C(15)H(13)ClN(4)O(5)S·C(3)H(7)NO, contains one mol­ecule each of the Schiff base and the solvent di­methyl­formamide. The hydrazone group adopts an E configuration about the C=N bond. The dihedral angle between the two aromatic rings is 86.58 (2)°. In the c...

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Autores principales: Purandara, H., Foro, S., Thimme Gowda, B.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5947811/
https://www.ncbi.nlm.nih.gov/pubmed/29765731
http://dx.doi.org/10.1107/S205698901800292X
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author Purandara, H.
Foro, S.
Thimme Gowda, B.
author_facet Purandara, H.
Foro, S.
Thimme Gowda, B.
author_sort Purandara, H.
collection PubMed
description The asymmetric unit of the title compound, C(15)H(13)ClN(4)O(5)S·C(3)H(7)NO, contains one mol­ecule each of the Schiff base and the solvent di­methyl­formamide. The hydrazone group adopts an E configuration about the C=N bond. The dihedral angle between the two aromatic rings is 86.58 (2)°. In the crystal, pairs of N—H⋯O hydrogen bonds between centrosymmetrically related mol­ecules generates rings with an R (2) (2)(10) graph-set motif. The dimers are further linked via N—H⋯O and C—H⋯O hydrogen bonds, leading to the formation of R (3) (3)(11) ring motifs. C—H⋯π inter­actions are also observed. The inter­molecular inter­actions in the crystal structure were qu­anti­fied and analysed using Hirshfeld surface analysis, which indicates that the most significant contacts in packing are O⋯H/H⋯O (31.3%), followed by H⋯H (25.4%) and C⋯H/H⋯C (13.0%).
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spelling pubmed-59478112018-05-15 Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate Purandara, H. Foro, S. Thimme Gowda, B. Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, C(15)H(13)ClN(4)O(5)S·C(3)H(7)NO, contains one mol­ecule each of the Schiff base and the solvent di­methyl­formamide. The hydrazone group adopts an E configuration about the C=N bond. The dihedral angle between the two aromatic rings is 86.58 (2)°. In the crystal, pairs of N—H⋯O hydrogen bonds between centrosymmetrically related mol­ecules generates rings with an R (2) (2)(10) graph-set motif. The dimers are further linked via N—H⋯O and C—H⋯O hydrogen bonds, leading to the formation of R (3) (3)(11) ring motifs. C—H⋯π inter­actions are also observed. The inter­molecular inter­actions in the crystal structure were qu­anti­fied and analysed using Hirshfeld surface analysis, which indicates that the most significant contacts in packing are O⋯H/H⋯O (31.3%), followed by H⋯H (25.4%) and C⋯H/H⋯C (13.0%). International Union of Crystallography 2018-02-23 /pmc/articles/PMC5947811/ /pubmed/29765731 http://dx.doi.org/10.1107/S205698901800292X Text en © Purandara et al. 2018 http://creativecommons.org/licenses/by/2.0/uk/ 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.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
Purandara, H.
Foro, S.
Thimme Gowda, B.
Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate
title Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate
title_full Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate
title_fullStr Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate
title_full_unstemmed Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate
title_short Crystal structure and Hirshfeld surface analysis of (E)-4-chloro-N-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide N,N-di­methyl­formamide monosolvate
title_sort crystal structure and hirshfeld surface analysis of (e)-4-chloro-n-{2-[2-(4-nitro­benzyl­idene)hydrazin-1-yl]-2-oxoeth­yl}benzene­sulfonamide n,n-di­methyl­formamide monosolvate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5947811/
https://www.ncbi.nlm.nih.gov/pubmed/29765731
http://dx.doi.org/10.1107/S205698901800292X
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