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N-(Diethyl­carbamothio­yl)-4-nitro­benzamide

In the title compound, C(12)H(15)N(3)O(3)S, the 4-nitro and carbonyl groups are nearly coplanar with the benzene ring [C—C—N—O = −175.72 (14) and C—C—C—O = 172.75 (14)°]. The diethyl­carbamothioyl group is twisted significantly from the plane of the benzene ring [C—N—C—N = −89.79 (15)°] with the S a...

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Autores principales: Saeed, Sohail, Rashid, Naghmana, Jasinski, Jerry P., Butcher, Ray J., Rizwan, Hussain
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983343/
https://www.ncbi.nlm.nih.gov/pubmed/21587569
http://dx.doi.org/10.1107/S1600536810036366
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author Saeed, Sohail
Rashid, Naghmana
Jasinski, Jerry P.
Butcher, Ray J.
Rizwan, Hussain
author_facet Saeed, Sohail
Rashid, Naghmana
Jasinski, Jerry P.
Butcher, Ray J.
Rizwan, Hussain
author_sort Saeed, Sohail
collection PubMed
description In the title compound, C(12)H(15)N(3)O(3)S, the 4-nitro and carbonyl groups are nearly coplanar with the benzene ring [C—C—N—O = −175.72 (14) and C—C—C—O = 172.75 (14)°]. The diethyl­carbamothioyl group is twisted significantly from the plane of the benzene ring [C—N—C—N = −89.79 (15)°] with the S atom pointing away from each of these groups [C—N—C—S = 91.12 (14)°]. In the crystal, an inter­molecular N—H⋯O hydrogen bond, which forms an infinite polymeric chain along the c axis, and weak C—H⋯O and C—H⋯S hydrogen bonds are observed.
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spelling pubmed-29833432010-12-30 N-(Diethyl­carbamothio­yl)-4-nitro­benzamide Saeed, Sohail Rashid, Naghmana Jasinski, Jerry P. Butcher, Ray J. Rizwan, Hussain Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(12)H(15)N(3)O(3)S, the 4-nitro and carbonyl groups are nearly coplanar with the benzene ring [C—C—N—O = −175.72 (14) and C—C—C—O = 172.75 (14)°]. The diethyl­carbamothioyl group is twisted significantly from the plane of the benzene ring [C—N—C—N = −89.79 (15)°] with the S atom pointing away from each of these groups [C—N—C—S = 91.12 (14)°]. In the crystal, an inter­molecular N—H⋯O hydrogen bond, which forms an infinite polymeric chain along the c axis, and weak C—H⋯O and C—H⋯S hydrogen bonds are observed. International Union of Crystallography 2010-09-18 /pmc/articles/PMC2983343/ /pubmed/21587569 http://dx.doi.org/10.1107/S1600536810036366 Text en © Saeed et al. 2010 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
Saeed, Sohail
Rashid, Naghmana
Jasinski, Jerry P.
Butcher, Ray J.
Rizwan, Hussain
N-(Diethyl­carbamothio­yl)-4-nitro­benzamide
title N-(Diethyl­carbamothio­yl)-4-nitro­benzamide
title_full N-(Diethyl­carbamothio­yl)-4-nitro­benzamide
title_fullStr N-(Diethyl­carbamothio­yl)-4-nitro­benzamide
title_full_unstemmed N-(Diethyl­carbamothio­yl)-4-nitro­benzamide
title_short N-(Diethyl­carbamothio­yl)-4-nitro­benzamide
title_sort n-(diethyl­carbamothio­yl)-4-nitro­benzamide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983343/
https://www.ncbi.nlm.nih.gov/pubmed/21587569
http://dx.doi.org/10.1107/S1600536810036366
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