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1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea

In the title mol­ecule, C(18)H(20)F(2)N(2)O(2)S, the 2,6-difluoro-4-hy­droxy­phenyl ring and the carbonyl­thio­urea group are each essentially planar, with maximum deviations of atoms from their mean planes of 0.0113 (14) and 0.1017 (15) Å, respectively; the dihedral angle between these two planes i...

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Autores principales: Mohamed, Shaaban K., Jaber, Abdel-Aal M., Saeed, Sohail, Ahmad, Khuram Shahzad, Wong, Wing-Tak
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379207/
https://www.ncbi.nlm.nih.gov/pubmed/22719405
http://dx.doi.org/10.1107/S1600536812018806
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author Mohamed, Shaaban K.
Jaber, Abdel-Aal M.
Saeed, Sohail
Ahmad, Khuram Shahzad
Wong, Wing-Tak
author_facet Mohamed, Shaaban K.
Jaber, Abdel-Aal M.
Saeed, Sohail
Ahmad, Khuram Shahzad
Wong, Wing-Tak
author_sort Mohamed, Shaaban K.
collection PubMed
description In the title mol­ecule, C(18)H(20)F(2)N(2)O(2)S, the 2,6-difluoro-4-hy­droxy­phenyl ring and the carbonyl­thio­urea group are each essentially planar, with maximum deviations of atoms from their mean planes of 0.0113 (14) and 0.1017 (15) Å, respectively; the dihedral angle between these two planes is 71.03 (6)°. An intra­molecular N—H⋯O hydrogen bond occurs. In the crystal, N—H⋯O and O—H⋯S hydrogen bonds connect the mol­ecules into chains running diagonally across the bc plane. C—H⋯S and C—H⋯F contacts are also observed.
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spelling pubmed-33792072012-06-20 1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea Mohamed, Shaaban K. Jaber, Abdel-Aal M. Saeed, Sohail Ahmad, Khuram Shahzad Wong, Wing-Tak Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title mol­ecule, C(18)H(20)F(2)N(2)O(2)S, the 2,6-difluoro-4-hy­droxy­phenyl ring and the carbonyl­thio­urea group are each essentially planar, with maximum deviations of atoms from their mean planes of 0.0113 (14) and 0.1017 (15) Å, respectively; the dihedral angle between these two planes is 71.03 (6)°. An intra­molecular N—H⋯O hydrogen bond occurs. In the crystal, N—H⋯O and O—H⋯S hydrogen bonds connect the mol­ecules into chains running diagonally across the bc plane. C—H⋯S and C—H⋯F contacts are also observed. International Union of Crystallography 2012-05-02 /pmc/articles/PMC3379207/ /pubmed/22719405 http://dx.doi.org/10.1107/S1600536812018806 Text en © Mohamed 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
Mohamed, Shaaban K.
Jaber, Abdel-Aal M.
Saeed, Sohail
Ahmad, Khuram Shahzad
Wong, Wing-Tak
1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea
title 1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea
title_full 1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea
title_fullStr 1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea
title_full_unstemmed 1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea
title_short 1-(Adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea
title_sort 1-(adamantan-1-ylcarbon­yl)-3-(2,6-difluoro-4-hy­droxy­phen­yl)thio­urea
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379207/
https://www.ncbi.nlm.nih.gov/pubmed/22719405
http://dx.doi.org/10.1107/S1600536812018806
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