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Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate

The title compounds, C(16)H(14)O(2)S(2) and C(16)H(14)O(3)S, which are monomeric models (models D and E) for a polythio­noester and a poly(ester-co-thio­noester), respectively, crystallize in the space group P2(1)/c and are isostructural with each other. The mol­ecule in each crystal is located on a...

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Autores principales: Tanaka, Syuto, Masu, Hyuma, Sasanuma, Yuji
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5730289/
https://www.ncbi.nlm.nih.gov/pubmed/29250352
http://dx.doi.org/10.1107/S2056989017012701
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author Tanaka, Syuto
Masu, Hyuma
Sasanuma, Yuji
author_facet Tanaka, Syuto
Masu, Hyuma
Sasanuma, Yuji
author_sort Tanaka, Syuto
collection PubMed
description The title compounds, C(16)H(14)O(2)S(2) and C(16)H(14)O(3)S, which are monomeric models (models D and E) for a polythio­noester and a poly(ester-co-thio­noester), respectively, crystallize in the space group P2(1)/c and are isostructural with each other. The mol­ecule in each crystal is located on an inversion centre and has an all-trans structure. The asymmetric unit comprises one half-mol­ecule. In the crystal, there are inter­molecular C⋯S contacts [3.391 (3) and 3.308 (3) Å for models D and E, respectively] and C—H⋯π inter­actions, which form a layer structure parallel to the bc plane. The carbonyl and thio­carbonyl groups of the model E compound are each disordered over two equivalent sites about the inversion centre with equal occupancies.
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spelling pubmed-57302892017-12-15 Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate Tanaka, Syuto Masu, Hyuma Sasanuma, Yuji Acta Crystallogr E Crystallogr Commun Research Communications The title compounds, C(16)H(14)O(2)S(2) and C(16)H(14)O(3)S, which are monomeric models (models D and E) for a polythio­noester and a poly(ester-co-thio­noester), respectively, crystallize in the space group P2(1)/c and are isostructural with each other. The mol­ecule in each crystal is located on an inversion centre and has an all-trans structure. The asymmetric unit comprises one half-mol­ecule. In the crystal, there are inter­molecular C⋯S contacts [3.391 (3) and 3.308 (3) Å for models D and E, respectively] and C—H⋯π inter­actions, which form a layer structure parallel to the bc plane. The carbonyl and thio­carbonyl groups of the model E compound are each disordered over two equivalent sites about the inversion centre with equal occupancies. International Union of Crystallography 2017-09-08 /pmc/articles/PMC5730289/ /pubmed/29250352 http://dx.doi.org/10.1107/S2056989017012701 Text en © Tanaka et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
Tanaka, Syuto
Masu, Hyuma
Sasanuma, Yuji
Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate
title Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate
title_full Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate
title_fullStr Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate
title_full_unstemmed Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate
title_short Crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate
title_sort crystal structures of 2-(benzene­carbo­thio­yloxy)ethyl benzene­carbo­thio­ate and 2-(benzene­carbo­thio­yloxy)ethyl benzoate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5730289/
https://www.ncbi.nlm.nih.gov/pubmed/29250352
http://dx.doi.org/10.1107/S2056989017012701
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