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5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph
In the title orthorhombic polymorph (space group Iba2), C(17)H(13)N, the dihedral angle between the benzene rings is 55.99 (10)° and the azepine ring adopts a boat conformation. In the crystal, molecules are linked by C—H⋯π contacts. The previously-reported polymorph [Yousuf et al. (2012 ▶). Acta...
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2012
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588308/ https://www.ncbi.nlm.nih.gov/pubmed/23476404 http://dx.doi.org/10.1107/S1600536812048908 |
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| author | Abdoh, M. M. M. Madan Kumar, S. Vinay Kumar, K. S. Manjunath, B. C. Sadashiva, M. P. Lokanath, N. K. |
| author_facet | Abdoh, M. M. M. Madan Kumar, S. Vinay Kumar, K. S. Manjunath, B. C. Sadashiva, M. P. Lokanath, N. K. |
| author_sort | Abdoh, M. M. M. |
| collection | PubMed |
| description | In the title orthorhombic polymorph (space group Iba2), C(17)H(13)N, the dihedral angle between the benzene rings is 55.99 (10)° and the azepine ring adopts a boat conformation. In the crystal, molecules are linked by C—H⋯π contacts. The previously-reported polymorph [Yousuf et al. (2012 ▶). Acta Cryst. E68, o1101] crystallizes in the monoclinic system (space group P2(1)/c) with two molecules in the asymmetric unit. |
| format | Online Article Text |
| id | pubmed-3588308 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2012 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-35883082013-03-08 5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph Abdoh, M. M. M. Madan Kumar, S. Vinay Kumar, K. S. Manjunath, B. C. Sadashiva, M. P. Lokanath, N. K. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title orthorhombic polymorph (space group Iba2), C(17)H(13)N, the dihedral angle between the benzene rings is 55.99 (10)° and the azepine ring adopts a boat conformation. In the crystal, molecules are linked by C—H⋯π contacts. The previously-reported polymorph [Yousuf et al. (2012 ▶). Acta Cryst. E68, o1101] crystallizes in the monoclinic system (space group P2(1)/c) with two molecules in the asymmetric unit. International Union of Crystallography 2012-12-05 /pmc/articles/PMC3588308/ /pubmed/23476404 http://dx.doi.org/10.1107/S1600536812048908 Text en © Abdoh et al. 2013 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 Abdoh, M. M. M. Madan Kumar, S. Vinay Kumar, K. S. Manjunath, B. C. Sadashiva, M. P. Lokanath, N. K. 5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph |
| title | 5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph |
| title_full | 5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph |
| title_fullStr | 5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph |
| title_full_unstemmed | 5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph |
| title_short | 5-(Prop-2-yn-1-yl)-5H-dibenzo[b,f]azepine: orthorhombic polymorph |
| title_sort | 5-(prop-2-yn-1-yl)-5h-dibenzo[b,f]azepine: orthorhombic polymorph |
| topic | Organic Papers |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588308/ https://www.ncbi.nlm.nih.gov/pubmed/23476404 http://dx.doi.org/10.1107/S1600536812048908 |
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