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Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine
In the title compound, C(24)H(22)Br(2)N(2)S, the dihedral angles between the central pyrimidine ring and the pendant bromobenzene rings are 11.02 (11) and 13.20 (12)°. The butyl side chain adopts a gauche conformation [C—C—C—C = −67.4 (4)°]. In the crystal, weak aromatic π–π stacking is observed be...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257452/ https://www.ncbi.nlm.nih.gov/pubmed/25553047 http://dx.doi.org/10.1107/S1600536814024714 |
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author | Yu, Wang Song, Jingbao Wang, Aijian |
author_facet | Yu, Wang Song, Jingbao Wang, Aijian |
author_sort | Yu, Wang |
collection | PubMed |
description | In the title compound, C(24)H(22)Br(2)N(2)S, the dihedral angles between the central pyrimidine ring and the pendant bromobenzene rings are 11.02 (11) and 13.20 (12)°. The butyl side chain adopts a gauche conformation [C—C—C—C = −67.4 (4)°]. In the crystal, weak aromatic π–π stacking is observed between the pyrimidine ring and one of the benzene rings [centroid–centroid separation = 3.6718 (17) Å]. |
format | Online Article Text |
id | pubmed-4257452 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-42574522014-12-31 Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine Yu, Wang Song, Jingbao Wang, Aijian Acta Crystallogr Sect E Struct Rep Online Data Reports In the title compound, C(24)H(22)Br(2)N(2)S, the dihedral angles between the central pyrimidine ring and the pendant bromobenzene rings are 11.02 (11) and 13.20 (12)°. The butyl side chain adopts a gauche conformation [C—C—C—C = −67.4 (4)°]. In the crystal, weak aromatic π–π stacking is observed between the pyrimidine ring and one of the benzene rings [centroid–centroid separation = 3.6718 (17) Å]. International Union of Crystallography 2014-11-21 /pmc/articles/PMC4257452/ /pubmed/25553047 http://dx.doi.org/10.1107/S1600536814024714 Text en © Yu et al. 2014 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 | Data Reports Yu, Wang Song, Jingbao Wang, Aijian Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine |
title | Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine |
title_full | Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine |
title_fullStr | Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine |
title_full_unstemmed | Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine |
title_short | Crystal structure of 4,6-bis[(E)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine |
title_sort | crystal structure of 4,6-bis[(e)-4-bromostyryl]-2-(butylsulfanyl)pyrimidine |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257452/ https://www.ncbi.nlm.nih.gov/pubmed/25553047 http://dx.doi.org/10.1107/S1600536814024714 |
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