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2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole
The molecule of the title compound, C(24)H(16)BrN(3)OS(3), contains three approximately planar fragments, viz. an oxadiazole ring plus two adjacent thiophene groups, and two phenothiazine benzene rings, with largest deviations from the least-squares planes of 0.051 (3), 0.019 (4) and 0.014 (3) Å,...
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/PMC3344512/ https://www.ncbi.nlm.nih.gov/pubmed/22590274 http://dx.doi.org/10.1107/S160053681201361X |
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author | Pan, Yu-Zhen Wang, You-Gui Liu, Jian-Hui Sun, Li-Cheng |
author_facet | Pan, Yu-Zhen Wang, You-Gui Liu, Jian-Hui Sun, Li-Cheng |
author_sort | Pan, Yu-Zhen |
collection | PubMed |
description | The molecule of the title compound, C(24)H(16)BrN(3)OS(3), contains three approximately planar fragments, viz. an oxadiazole ring plus two adjacent thiophene groups, and two phenothiazine benzene rings, with largest deviations from the least-squares planes of 0.051 (3), 0.019 (4) and 0.014 (3) Å, respectively. The phenothiazine unit adopts a butterfly conformation, with a dihedral angle of 38.06 (15)° between the terminal benzene rings. The dihedral angle between the 2,5-bis(thiophen-2-yl)oxadiazole unit and the attached benzene ring is 15.35 (11)°. In the crystal, molecules form stacks along the b-axis direction; neighboring molecules within the stack are related by inversion centers, with shortest intercentroid separations of 3.741 (2) and 3.767 (2) Å. |
format | Online Article Text |
id | pubmed-3344512 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33445122012-05-15 2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole Pan, Yu-Zhen Wang, You-Gui Liu, Jian-Hui Sun, Li-Cheng Acta Crystallogr Sect E Struct Rep Online Organic Papers The molecule of the title compound, C(24)H(16)BrN(3)OS(3), contains three approximately planar fragments, viz. an oxadiazole ring plus two adjacent thiophene groups, and two phenothiazine benzene rings, with largest deviations from the least-squares planes of 0.051 (3), 0.019 (4) and 0.014 (3) Å, respectively. The phenothiazine unit adopts a butterfly conformation, with a dihedral angle of 38.06 (15)° between the terminal benzene rings. The dihedral angle between the 2,5-bis(thiophen-2-yl)oxadiazole unit and the attached benzene ring is 15.35 (11)°. In the crystal, molecules form stacks along the b-axis direction; neighboring molecules within the stack are related by inversion centers, with shortest intercentroid separations of 3.741 (2) and 3.767 (2) Å. International Union of Crystallography 2012-04-13 /pmc/articles/PMC3344512/ /pubmed/22590274 http://dx.doi.org/10.1107/S160053681201361X Text en © Pan 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 Pan, Yu-Zhen Wang, You-Gui Liu, Jian-Hui Sun, Li-Cheng 2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole |
title | 2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole |
title_full | 2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole |
title_fullStr | 2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole |
title_full_unstemmed | 2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole |
title_short | 2-(5-Bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole |
title_sort | 2-(5-bromothiophen-2-yl)-5-[5-(10-ethylphenothiazin-3-yl)thiophen-2-yl]-1,3,4-oxadiazole |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344512/ https://www.ncbi.nlm.nih.gov/pubmed/22590274 http://dx.doi.org/10.1107/S160053681201361X |
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