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(1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)

In the mol­ecule of the title compound, C(14)H(20)N(4)O(3), the five-membered ring adopts an envelope conformation with the O atom displaced by 0.207 (3) Å from the plane of the other ring atoms. Intra­molecular C—H⋯O hydrogen bonds result in the formation of three five-membered rings having envelop...

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Autores principales: Maliha, Bushra, Tariq, Muhammad Ilyas, Tahir, M. Nawaz, Hussain, Ishtiaq, Siddiqui, Hamid Latif
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2967959/
https://www.ncbi.nlm.nih.gov/pubmed/21581685
http://dx.doi.org/10.1107/S1600536808040828
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author Maliha, Bushra
Tariq, Muhammad Ilyas
Tahir, M. Nawaz
Hussain, Ishtiaq
Siddiqui, Hamid Latif
author_facet Maliha, Bushra
Tariq, Muhammad Ilyas
Tahir, M. Nawaz
Hussain, Ishtiaq
Siddiqui, Hamid Latif
author_sort Maliha, Bushra
collection PubMed
description In the mol­ecule of the title compound, C(14)H(20)N(4)O(3), the five-membered ring adopts an envelope conformation with the O atom displaced by 0.207 (3) Å from the plane of the other ring atoms. Intra­molecular C—H⋯O hydrogen bonds result in the formation of three five-membered rings having envelope conformations. In the crystal structure, inter­molecular N—H⋯O hydrogen bonds link the mol­ecules, forming R (2) (2)(20) ring motifs, which produce two-dimensional polymeric sheets extending along the b axis. There are also two C—H⋯π inter­actions. The H atoms of one of the methyl groups are disordered over two positions and were refined with occupancies of 0.50.
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spelling pubmed-29679592010-12-30 (1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea) Maliha, Bushra Tariq, Muhammad Ilyas Tahir, M. Nawaz Hussain, Ishtiaq Siddiqui, Hamid Latif Acta Crystallogr Sect E Struct Rep Online Organic Papers In the mol­ecule of the title compound, C(14)H(20)N(4)O(3), the five-membered ring adopts an envelope conformation with the O atom displaced by 0.207 (3) Å from the plane of the other ring atoms. Intra­molecular C—H⋯O hydrogen bonds result in the formation of three five-membered rings having envelope conformations. In the crystal structure, inter­molecular N—H⋯O hydrogen bonds link the mol­ecules, forming R (2) (2)(20) ring motifs, which produce two-dimensional polymeric sheets extending along the b axis. There are also two C—H⋯π inter­actions. The H atoms of one of the methyl groups are disordered over two positions and were refined with occupancies of 0.50. International Union of Crystallography 2008-12-06 /pmc/articles/PMC2967959/ /pubmed/21581685 http://dx.doi.org/10.1107/S1600536808040828 Text en © Maliha et al. 2009 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
Maliha, Bushra
Tariq, Muhammad Ilyas
Tahir, M. Nawaz
Hussain, Ishtiaq
Siddiqui, Hamid Latif
(1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)
title (1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)
title_full (1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)
title_fullStr (1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)
title_full_unstemmed (1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)
title_short (1R,3S)-1,1′-(1,3-Dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)
title_sort (1r,3s)-1,1′-(1,3-dihydro-2-benzofuran-1,3-diyl)bis(1,3-dimethyl­urea)
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2967959/
https://www.ncbi.nlm.nih.gov/pubmed/21581685
http://dx.doi.org/10.1107/S1600536808040828
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