3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate

The title compound, C(9)H(12)N(2)OS(4)·0.5C(6)H(5)Cl, which contains two 1,3-thia­zolidine-2-thione rings, is a by-product of the synthesis of 3-acryloyl-1,3-thia­zolidine-2-thione. The dihedral angle between these rings is 79.95 (9)°, with both rings displaying a twisted conformation. The twist ang...

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Detalles Bibliográficos
Autores principales: Franzel, Christine, Purdy, Andrew, Butcher, Ray J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588431/
https://www.ncbi.nlm.nih.gov/pubmed/23476562
http://dx.doi.org/10.1107/S1600536813003292
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author Franzel, Christine
Purdy, Andrew
Butcher, Ray J.
author_facet Franzel, Christine
Purdy, Andrew
Butcher, Ray J.
author_sort Franzel, Christine
collection PubMed
description The title compound, C(9)H(12)N(2)OS(4)·0.5C(6)H(5)Cl, which contains two 1,3-thia­zolidine-2-thione rings, is a by-product of the synthesis of 3-acryloyl-1,3-thia­zolidine-2-thione. The dihedral angle between these rings is 79.95 (9)°, with both rings displaying a twisted conformation. The twist angle of the amide group is 5.6 (1)°. In the crystal, the molecules are linked into [001] chains by C—H⋯O interactions. The chloro­benzene solvent mol­ecule was found to show unresolvable disorder about a centre of inversion and its contribution to the scattering was removed with the SQUEEZE option in PLATON [Spek (2009 ▶). Acta Cryst. D65, 148–155].
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spelling pubmed-35884312013-03-08 3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate Franzel, Christine Purdy, Andrew Butcher, Ray J. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(9)H(12)N(2)OS(4)·0.5C(6)H(5)Cl, which contains two 1,3-thia­zolidine-2-thione rings, is a by-product of the synthesis of 3-acryloyl-1,3-thia­zolidine-2-thione. The dihedral angle between these rings is 79.95 (9)°, with both rings displaying a twisted conformation. The twist angle of the amide group is 5.6 (1)°. In the crystal, the molecules are linked into [001] chains by C—H⋯O interactions. The chloro­benzene solvent mol­ecule was found to show unresolvable disorder about a centre of inversion and its contribution to the scattering was removed with the SQUEEZE option in PLATON [Spek (2009 ▶). Acta Cryst. D65, 148–155]. International Union of Crystallography 2013-02-13 /pmc/articles/PMC3588431/ /pubmed/23476562 http://dx.doi.org/10.1107/S1600536813003292 Text en © Franzel 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
Franzel, Christine
Purdy, Andrew
Butcher, Ray J.
3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate
title 3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate
title_full 3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate
title_fullStr 3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate
title_full_unstemmed 3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate
title_short 3,3′-(1-Oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate
title_sort 3,3′-(1-oxopropane-1,3-di­yl)bis­(1,3-thia­zolidine-2-thione) chloro­benzene hemisolvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588431/
https://www.ncbi.nlm.nih.gov/pubmed/23476562
http://dx.doi.org/10.1107/S1600536813003292
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AT purdyandrew 331oxopropane13diylbis13thiazolidine2thionechlorobenzenehemisolvate
AT butcherrayj 331oxopropane13diylbis13thiazolidine2thionechlorobenzenehemisolvate

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