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Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide

In the title compound, C(17)H(20)ClN(3)OS, the mean plane of the central thio­urea core makes dihedral angles of 26.56 (9) and 47.62 (12)° with the mean planes of the chromene moiety and the cyclo­hexyl ring, respectively. The cyclo­hexyl ring adopts a chair conformation. The N–H atoms of the thio­u...

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Autores principales: Gangadharan, Rajeswari, Haribabu, Jebiti, Karvembu, Ramasamy, Sethusankar, K.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186115/
https://www.ncbi.nlm.nih.gov/pubmed/25309214
http://dx.doi.org/10.1107/S1600536814018509
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author Gangadharan, Rajeswari
Haribabu, Jebiti
Karvembu, Ramasamy
Sethusankar, K.
author_facet Gangadharan, Rajeswari
Haribabu, Jebiti
Karvembu, Ramasamy
Sethusankar, K.
author_sort Gangadharan, Rajeswari
collection PubMed
description In the title compound, C(17)H(20)ClN(3)OS, the mean plane of the central thio­urea core makes dihedral angles of 26.56 (9) and 47.62 (12)° with the mean planes of the chromene moiety and the cyclo­hexyl ring, respectively. The cyclo­hexyl ring adopts a chair conformation. The N–H atoms of the thio­urea unit adopt an anti conformation. The chromene group is positioned trans, whereas the cyclo­hexyl ring lies in the cis position to the thione S atom, with respect to the thio­urea C—N bond. In the crystal, mol­ecules are linked by N—H⋯S hydrogen bonds, forming inversion dimers enclosing R (2) (2)(8) ring motifs. The dimers are linked by C—H⋯Cl hydrogen bonds, enclosing R (6) (6)(44) ring motifs, forming sheets lying parallel to (010).
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spelling pubmed-41861152014-10-12 Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide Gangadharan, Rajeswari Haribabu, Jebiti Karvembu, Ramasamy Sethusankar, K. Acta Crystallogr Sect E Struct Rep Online Data Reports In the title compound, C(17)H(20)ClN(3)OS, the mean plane of the central thio­urea core makes dihedral angles of 26.56 (9) and 47.62 (12)° with the mean planes of the chromene moiety and the cyclo­hexyl ring, respectively. The cyclo­hexyl ring adopts a chair conformation. The N–H atoms of the thio­urea unit adopt an anti conformation. The chromene group is positioned trans, whereas the cyclo­hexyl ring lies in the cis position to the thione S atom, with respect to the thio­urea C—N bond. In the crystal, mol­ecules are linked by N—H⋯S hydrogen bonds, forming inversion dimers enclosing R (2) (2)(8) ring motifs. The dimers are linked by C—H⋯Cl hydrogen bonds, enclosing R (6) (6)(44) ring motifs, forming sheets lying parallel to (010). International Union of Crystallography 2014-08-23 /pmc/articles/PMC4186115/ /pubmed/25309214 http://dx.doi.org/10.1107/S1600536814018509 Text en © Gangadharan et al. 2014 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 Data Reports
Gangadharan, Rajeswari
Haribabu, Jebiti
Karvembu, Ramasamy
Sethusankar, K.
Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide
title Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide
title_full Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide
title_fullStr Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide
title_full_unstemmed Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide
title_short Crystal structure of (E)-2-[(4-chloro-2H-chromen-3-yl)methyl­idene]-N-cyclo­hexyl­hydrazinecarbo­thio­amide
title_sort crystal structure of (e)-2-[(4-chloro-2h-chromen-3-yl)methyl­idene]-n-cyclo­hexyl­hydrazinecarbo­thio­amide
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186115/
https://www.ncbi.nlm.nih.gov/pubmed/25309214
http://dx.doi.org/10.1107/S1600536814018509
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