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5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione
In the title compound, C(15)H(16)N(2)O(5), the dihedral angle between 1,3-diazinane and benzene rings is only 4.27 (1)°. The essentially planar molecular structure is characterized by a short intramolecular C—H⋯O separation and by an exceptionally large bond angle of 138.25 (14)° at the bridging m...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3254518/ https://www.ncbi.nlm.nih.gov/pubmed/22259463 http://dx.doi.org/10.1107/S1600536811052986 |
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author | Gohain, Mukut Muller, Theunis J. Bezuidenhoudt, Barend C. B. |
author_facet | Gohain, Mukut Muller, Theunis J. Bezuidenhoudt, Barend C. B. |
author_sort | Gohain, Mukut |
collection | PubMed |
description | In the title compound, C(15)H(16)N(2)O(5), the dihedral angle between 1,3-diazinane and benzene rings is only 4.27 (1)°. The essentially planar molecular structure is characterized by a short intramolecular C—H⋯O separation and by an exceptionally large bond angle of 138.25 (14)° at the bridging methine C atom. The methoxy groups deviate somewhat from the plane of the benzene ring, with C—C—O—C torsion angles of −15.6 (1) and 9.17 (6)°. In the crystal, molecules form centrosymmetric dimers via donor–acceptor π–π interactions, with a centroid–centroid distance of 3.401 (1) Å. |
format | Online Article Text |
id | pubmed-3254518 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32545182012-01-18 5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione Gohain, Mukut Muller, Theunis J. Bezuidenhoudt, Barend C. B. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(16)N(2)O(5), the dihedral angle between 1,3-diazinane and benzene rings is only 4.27 (1)°. The essentially planar molecular structure is characterized by a short intramolecular C—H⋯O separation and by an exceptionally large bond angle of 138.25 (14)° at the bridging methine C atom. The methoxy groups deviate somewhat from the plane of the benzene ring, with C—C—O—C torsion angles of −15.6 (1) and 9.17 (6)°. In the crystal, molecules form centrosymmetric dimers via donor–acceptor π–π interactions, with a centroid–centroid distance of 3.401 (1) Å. International Union of Crystallography 2011-12-21 /pmc/articles/PMC3254518/ /pubmed/22259463 http://dx.doi.org/10.1107/S1600536811052986 Text en © Gohain 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 Gohain, Mukut Muller, Theunis J. Bezuidenhoudt, Barend C. B. 5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
title | 5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
title_full | 5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
title_fullStr | 5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
title_full_unstemmed | 5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
title_short | 5-(3,4-Dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
title_sort | 5-(3,4-dimethoxybenzylidene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3254518/ https://www.ncbi.nlm.nih.gov/pubmed/22259463 http://dx.doi.org/10.1107/S1600536811052986 |
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