1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene

The title thia­calix[4]arene derivative, C(72)H(80)O(4)S(8), adopts a 1,3-alternate conformation, where the four 4-methyl­sul­fan­yl­benzyl groups are located alternately at the two sides of a virtual plane defined by the four bridging S atoms. In the crystal, there are no significant inter­molecula...

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Detalles Bibliográficos
Autores principales: Gao, Qingsong, Xie, Dexun, An, Delie
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/PMC3772452/
https://www.ncbi.nlm.nih.gov/pubmed/24046595
http://dx.doi.org/10.1107/S1600536813014827
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author Gao, Qingsong
Xie, Dexun
An, Delie
author_facet Gao, Qingsong
Xie, Dexun
An, Delie
author_sort Gao, Qingsong
collection PubMed
description The title thia­calix[4]arene derivative, C(72)H(80)O(4)S(8), adopts a 1,3-alternate conformation, where the four 4-methyl­sul­fan­yl­benzyl groups are located alternately at the two sides of a virtual plane defined by the four bridging S atoms. In the crystal, there are no significant inter­molecular inter­actions present. Some of the peripheral tert-butyl and methyl­sulfanyl groups are disordered over two positions. A region of disordered electron density, occupying voids of ca 700 Å(3) for an electron count of 124, was treated using the SQUEEZE routine in PLATON [Spek (2009 ▶). Acta Cryst. D65, 148–155].
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spelling pubmed-37724522013-09-17 1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene Gao, Qingsong Xie, Dexun An, Delie Acta Crystallogr Sect E Struct Rep Online Organic Papers The title thia­calix[4]arene derivative, C(72)H(80)O(4)S(8), adopts a 1,3-alternate conformation, where the four 4-methyl­sul­fan­yl­benzyl groups are located alternately at the two sides of a virtual plane defined by the four bridging S atoms. In the crystal, there are no significant inter­molecular inter­actions present. Some of the peripheral tert-butyl and methyl­sulfanyl groups are disordered over two positions. A region of disordered electron density, occupying voids of ca 700 Å(3) for an electron count of 124, was treated using the SQUEEZE routine in PLATON [Spek (2009 ▶). Acta Cryst. D65, 148–155]. International Union of Crystallography 2013-06-08 /pmc/articles/PMC3772452/ /pubmed/24046595 http://dx.doi.org/10.1107/S1600536813014827 Text en © Gao 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
Gao, Qingsong
Xie, Dexun
An, Delie
1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene
title 1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene
title_full 1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene
title_fullStr 1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene
title_full_unstemmed 1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene
title_short 1,3-Alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene
title_sort 1,3-alternate conformer 5,11,17,23-tetra-tert-butyl-25,26,27,28-tetra­kis­(4-methyl­sulfanylbenz­yloxy)-2,8,14,20-tetra­thia­calix[4]arene
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3772452/
https://www.ncbi.nlm.nih.gov/pubmed/24046595
http://dx.doi.org/10.1107/S1600536813014827
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