Cargando…

5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole

The title compound, C(26)H(26)N(2)O(2)S, was prepared by the reaction of thio­phene-2,5-dicarboxylic acid and 2-amino-4-tert-butyl­phenol. One of the tert-butyl groups is disordered over two conformations, with occupancies of 0.539 (1) and 0.461 (2). The two 1,3-benzoxazole rings are almost planar,...

Descripción completa

Detalles Bibliográficos
Autores principales: Li, Yu-Feng, Wang, Lin-Tong, Jian, Fang-Fang
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959973/
https://www.ncbi.nlm.nih.gov/pubmed/21581379
http://dx.doi.org/10.1107/S1600536808037665
_version_ 1782188628048347136
author Li, Yu-Feng
Wang, Lin-Tong
Jian, Fang-Fang
author_facet Li, Yu-Feng
Wang, Lin-Tong
Jian, Fang-Fang
author_sort Li, Yu-Feng
collection PubMed
description The title compound, C(26)H(26)N(2)O(2)S, was prepared by the reaction of thio­phene-2,5-dicarboxylic acid and 2-amino-4-tert-butyl­phenol. One of the tert-butyl groups is disordered over two conformations, with occupancies of 0.539 (1) and 0.461 (2). The two 1,3-benzoxazole rings are almost planar, with dihedral angles of 0.83 (18) and 1.64 (17)° between the five- and six-membered rings. The thio­phene ring makes dihedral angles of 21.54 (19) and 4.49 (18)° with the planes of the five-membered oxazole rings. The crystal packing is controlled by π–π stacking inter­actions involving the thio­phene and benzene rings, with a centroid–centroid distance of 3.748 (2) Å.
format Text
id pubmed-2959973
institution National Center for Biotechnology Information
language English
publishDate 2008
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29599732010-12-30 5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole Li, Yu-Feng Wang, Lin-Tong Jian, Fang-Fang Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(26)H(26)N(2)O(2)S, was prepared by the reaction of thio­phene-2,5-dicarboxylic acid and 2-amino-4-tert-butyl­phenol. One of the tert-butyl groups is disordered over two conformations, with occupancies of 0.539 (1) and 0.461 (2). The two 1,3-benzoxazole rings are almost planar, with dihedral angles of 0.83 (18) and 1.64 (17)° between the five- and six-membered rings. The thio­phene ring makes dihedral angles of 21.54 (19) and 4.49 (18)° with the planes of the five-membered oxazole rings. The crystal packing is controlled by π–π stacking inter­actions involving the thio­phene and benzene rings, with a centroid–centroid distance of 3.748 (2) Å. International Union of Crystallography 2008-11-22 /pmc/articles/PMC2959973/ /pubmed/21581379 http://dx.doi.org/10.1107/S1600536808037665 Text en © Li et al. 2008 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
Li, Yu-Feng
Wang, Lin-Tong
Jian, Fang-Fang
5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole
title 5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole
title_full 5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole
title_fullStr 5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole
title_full_unstemmed 5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole
title_short 5-tert-Butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole
title_sort 5-tert-butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-thien­yl]-1,3-benzoxazole
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959973/
https://www.ncbi.nlm.nih.gov/pubmed/21581379
http://dx.doi.org/10.1107/S1600536808037665
work_keys_str_mv AT liyufeng 5tertbutyl255tertbutyl13benzoxazol2yl2thienyl13benzoxazole
AT wanglintong 5tertbutyl255tertbutyl13benzoxazol2yl2thienyl13benzoxazole
AT jianfangfang 5tertbutyl255tertbutyl13benzoxazol2yl2thienyl13benzoxazole