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Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide

The synthesis of the title compound, C(13)H(21)NO(2)S, is reported here along with its crystal structure. This compound crystallizes with two mol­ecules in the asymmetric unit. The sulfonamide functional group of this structure features S=O bond lengths ranging from 1.433 (3) to 1.439 (3) Å, S—C bon...

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Autores principales: Stenfors, Brock A., Staples, Richard J., Biros, Shannon M., Ngassa, Felix N.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7336799/
https://www.ncbi.nlm.nih.gov/pubmed/32695444
http://dx.doi.org/10.1107/S2056989020007185
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author Stenfors, Brock A.
Staples, Richard J.
Biros, Shannon M.
Ngassa, Felix N.
author_facet Stenfors, Brock A.
Staples, Richard J.
Biros, Shannon M.
Ngassa, Felix N.
author_sort Stenfors, Brock A.
collection PubMed
description The synthesis of the title compound, C(13)H(21)NO(2)S, is reported here along with its crystal structure. This compound crystallizes with two mol­ecules in the asymmetric unit. The sulfonamide functional group of this structure features S=O bond lengths ranging from 1.433 (3) to 1.439 (3) Å, S—C bond lengths of 1.777 (3) and 1.773 (4) Å, and S—N bond lengths of 1.622 (3) and 1.624 (3) Å. When viewing the mol­ecules down the S—N bond, the isopropyl groups are gauche to the aromatic ring. On each mol­ecule, two methyl hydrogen atoms of one isopropyl group are engaged in intra­molecular C—H⋯O hydrogen bonds with a nearby sulfonamide oxygen atom. Inter­molecular C—H⋯O hydrogen bonds and C—H⋯π inter­actions link mol­ecules of the title compound in the solid state.
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spelling pubmed-73367992020-07-20 Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide Stenfors, Brock A. Staples, Richard J. Biros, Shannon M. Ngassa, Felix N. Acta Crystallogr E Crystallogr Commun Research Communications The synthesis of the title compound, C(13)H(21)NO(2)S, is reported here along with its crystal structure. This compound crystallizes with two mol­ecules in the asymmetric unit. The sulfonamide functional group of this structure features S=O bond lengths ranging from 1.433 (3) to 1.439 (3) Å, S—C bond lengths of 1.777 (3) and 1.773 (4) Å, and S—N bond lengths of 1.622 (3) and 1.624 (3) Å. When viewing the mol­ecules down the S—N bond, the isopropyl groups are gauche to the aromatic ring. On each mol­ecule, two methyl hydrogen atoms of one isopropyl group are engaged in intra­molecular C—H⋯O hydrogen bonds with a nearby sulfonamide oxygen atom. Inter­molecular C—H⋯O hydrogen bonds and C—H⋯π inter­actions link mol­ecules of the title compound in the solid state. International Union of Crystallography 2020-06-05 /pmc/articles/PMC7336799/ /pubmed/32695444 http://dx.doi.org/10.1107/S2056989020007185 Text en © Stenfors et al. 2020 http://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.http://creativecommons.org/licenses/by/4.0/
spellingShingle Research Communications
Stenfors, Brock A.
Staples, Richard J.
Biros, Shannon M.
Ngassa, Felix N.
Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide
title Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide
title_full Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide
title_fullStr Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide
title_full_unstemmed Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide
title_short Crystal structure of N,N-diisopropyl-4-methyl­benzene­sulfonamide
title_sort crystal structure of n,n-diisopropyl-4-methyl­benzene­sulfonamide
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7336799/
https://www.ncbi.nlm.nih.gov/pubmed/32695444
http://dx.doi.org/10.1107/S2056989020007185
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