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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,...

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Autores principales: Pan, Yu-Zhen, Wang, You-Gui, Liu, Jian-Hui, Sun, Li-Cheng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
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.
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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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