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Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate
The asymmetric unit of the title compound, C(19)H(11)N(3)·C(2)H(2)Cl(4), consists of one half-molecule of 1,13,14-triazadibenz[a,j]anthracene (dibenzo[c,h]-1.9,10-anthyridine, dbanth) and one half of 1,1,2,2-tetrachloroethane (TCE), both of which are located on a crystallographic twofold rotati...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459339/ https://www.ncbi.nlm.nih.gov/pubmed/26090149 http://dx.doi.org/10.1107/S2056989015009263 |
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author | Koizumi, Take-aki Hariu, Tomohiro Sei, Yoshihisa |
author_facet | Koizumi, Take-aki Hariu, Tomohiro Sei, Yoshihisa |
author_sort | Koizumi, Take-aki |
collection | PubMed |
description | The asymmetric unit of the title compound, C(19)H(11)N(3)·C(2)H(2)Cl(4), consists of one half-molecule of 1,13,14-triazadibenz[a,j]anthracene (dibenzo[c,h]-1.9,10-anthyridine, dbanth) and one half of 1,1,2,2-tetrachloroethane (TCE), both of which are located on a crystallographic twofold rotation axis. The dihedral angle between the planes of the terminal benzene rings in dbanth is 3.59 (7)° owing to the steric repulsion between the H atoms in the two benzo groups and the H atom in the central pyridine ring of the anthridine skeleton. In the crystal, π–π interactions between pyridine rings [centroid–centroid distances = 3.568 (2) and 3.594 (2) Å] link the dbanth molecules to form a one-dimensional columnar structure along the c axis. The dbanth and TCE molecules are connected through weak bifurcated C—H⋯(N,N) hydrogen bonds. |
format | Online Article Text |
id | pubmed-4459339 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-44593392015-06-18 Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate Koizumi, Take-aki Hariu, Tomohiro Sei, Yoshihisa Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, C(19)H(11)N(3)·C(2)H(2)Cl(4), consists of one half-molecule of 1,13,14-triazadibenz[a,j]anthracene (dibenzo[c,h]-1.9,10-anthyridine, dbanth) and one half of 1,1,2,2-tetrachloroethane (TCE), both of which are located on a crystallographic twofold rotation axis. The dihedral angle between the planes of the terminal benzene rings in dbanth is 3.59 (7)° owing to the steric repulsion between the H atoms in the two benzo groups and the H atom in the central pyridine ring of the anthridine skeleton. In the crystal, π–π interactions between pyridine rings [centroid–centroid distances = 3.568 (2) and 3.594 (2) Å] link the dbanth molecules to form a one-dimensional columnar structure along the c axis. The dbanth and TCE molecules are connected through weak bifurcated C—H⋯(N,N) hydrogen bonds. International Union of Crystallography 2015-05-23 /pmc/articles/PMC4459339/ /pubmed/26090149 http://dx.doi.org/10.1107/S2056989015009263 Text en © Koizumi et al. 2015 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 | Research Communications Koizumi, Take-aki Hariu, Tomohiro Sei, Yoshihisa Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate |
title | Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate |
title_full | Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate |
title_fullStr | Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate |
title_full_unstemmed | Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate |
title_short | Crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate |
title_sort | crystal structure of 1,13,14-triazadibenz[a,j]anthracene 1,1,2,2-tetrachloroethane monosolvate |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459339/ https://www.ncbi.nlm.nih.gov/pubmed/26090149 http://dx.doi.org/10.1107/S2056989015009263 |
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