Suppr超能文献

1-[2-(2,5-二氯-苄氧基)-2-苯基-乙基]-1H-苯并三唑

1-[2-(2,5-Dichloro-benz-yloxy)-2-phenyl-eth-yl]-1H-benzotriazole.

作者信息

Ozel Güven Ozden, Bayraktar Meral, Coles Simon J, Hökelek Tuncer

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3177-8. doi: 10.1107/S1600536811044783. Epub 2011 Nov 5.

Abstract

In the title mol-ecule, C(21)H(17)Cl(2)N(3)O, the benzotriazole ring is oriented at dihedral angles of 48.72 (6) and 62.94 (5)°, respectively, to the phenyl and benzene rings and the dihedral angle between the phenyl and benzene rings is 88.95 (6)°. In the crystal, weak C-H⋯N hydrogen bonds link the mol-ecules into chains. π-π contacts between the triazole and benzene rings [centroid-centroid distance = 3.678 (1) Å] and a weak C-H⋯π inter-action are also observed.

摘要

在标题分子C(21)H(17)Cl(2)N(3)O中,苯并三唑环与苯环和苯基环的二面角分别为48.72 (6)°和62.94 (5)°,苯基环和苯环之间的二面角为88.95 (6)°。在晶体中,弱的C-H⋯N氢键将分子连接成链。还观察到三唑环与苯环之间的π-π接触[质心-质心距离 = 3.678 (1) Å]以及弱的C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/7a6e/3238848/3f7ec750685f/e-67-o3177-fig1.jpg

相似文献

1
1-[2-(2,5-Dichloro-benz-yloxy)-2-phenyl-eth-yl]-1H-benzotriazole.1-[2-(2,5-二氯-苄氧基)-2-苯基-乙基]-1H-苯并三唑
Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3177-8. doi: 10.1107/S1600536811044783. Epub 2011 Nov 5.
2
1-[2-(2,4-Dichloro-benz-yloxy)-2-(furan-2-yl)eth-yl]-1H-benzotriazole.1-[2-(2,4-二氯苄氧基)-2-(呋喃-2-基)乙基]-1H-苯并三唑
Acta Crystallogr Sect E Struct Rep Online. 2012 Jan;68(Pt 1):o139-40. doi: 10.1107/S1600536811053104. Epub 2011 Dec 17.
3
1-[2-(2,6-Dichloro-benz-yloxy)-2-(2-fur-yl)eth-yl]-1H-1,2,4-triazole.1-[2-(2,6-二氯苄氧基)-2-(2-呋喃基)乙基]-1H-1,2,4-三唑
Acta Crystallogr Sect E Struct Rep Online. 2009 Dec 12;66(Pt 1):o107-8. doi: 10.1107/S1600536809052568.
4
1-[2-(2,6-Dichloro-benz-yloxy)-2-(2-fur-yl)eth-yl]-1H-benzimidazole.1-[2-(2,6-二氯苄氧基)-2-(2-呋喃基)乙基]-1H-苯并咪唑
Acta Crystallogr Sect E Struct Rep Online. 2008 Jul 9;64(Pt 8):o1437. doi: 10.1107/S1600536808020758.
5
2-(1H-Benzotriazol-1-yl)-3-(2,6-dichloro-phen-yl)-1-phenyl-propan-1-ol.2-(1H-苯并三唑-1-基)-3-(2,6-二氯苯基)-1-苯基丙-1-醇
Acta Crystallogr Sect E Struct Rep Online. 2011 Sep 1;67(Pt 9):o2510. doi: 10.1107/S1600536811034738. Epub 2011 Aug 27.
6
2-(1H-Benzotriazol-1-yl)-1-phenyl-ethanol.2-(1H-苯并三唑-1-基)-1-苯基乙醇
Acta Crystallogr Sect E Struct Rep Online. 2010 Mar 27;66(Pt 4):o959. doi: 10.1107/S1600536810011098.
8
1-[2-(4-Fluoro-benz-yloxy)-2-phenyl-ethyl]-1H-benzimidazole.1-[2-(4-氟苯氧基)-2-苯基乙基]-1H-苯并咪唑
Acta Crystallogr Sect E Struct Rep Online. 2008 Jul 16;64(Pt 8):o1496-7. doi: 10.1107/S1600536808021326.
9
1-[2-(2,4-Dichloro-benz-yloxy)-2-(2-fur-yl)eth-yl]-1H-1,2,4-triazole.1-[2-(2,4-二氯苄氧基)-2-(2-呋喃基)乙基]-1H-1,2,4-三唑
Acta Crystallogr Sect E Struct Rep Online. 2009 Oct 28;65(Pt 11):o2868-9. doi: 10.1107/S1600536809044018.
10
5-(3-Methoxy-pheneth-yl)-4-(2-methoxy-phen-yl)-4H-1,2,4-triazol-3-ol.5-(3-甲氧基-苯乙基)-4-(2-甲氧基-苯基)-4H-1,2,4-三唑-3-醇
Acta Crystallogr Sect E Struct Rep Online. 2008 Oct 25;64(Pt 11):o2180. doi: 10.1107/S1600536808033990.

引用本文的文献

1
1-[2-(2,4-Dichloro-benz-yloxy)-2-(furan-2-yl)eth-yl]-1H-benzotriazole.1-[2-(2,4-二氯苄氧基)-2-(呋喃-2-基)乙基]-1H-苯并三唑
Acta Crystallogr Sect E Struct Rep Online. 2012 Jan;68(Pt 1):o139-40. doi: 10.1107/S1600536811053104. Epub 2011 Dec 17.

本文引用的文献

1
2-(1H-Benzotriazol-1-yl)-3-(2,6-dichloro-phen-yl)-1-phenyl-propan-1-ol.2-(1H-苯并三唑-1-基)-3-(2,6-二氯苯基)-1-苯基丙-1-醇
Acta Crystallogr Sect E Struct Rep Online. 2011 Sep 1;67(Pt 9):o2510. doi: 10.1107/S1600536811034738. Epub 2011 Aug 27.
2
2-(1H-Benzotriazol-1-yl)-1-phenyl-ethanol.2-(1H-苯并三唑-1-基)-1-苯基乙醇
Acta Crystallogr Sect E Struct Rep Online. 2010 Mar 27;66(Pt 4):o959. doi: 10.1107/S1600536810011098.
3
1-[2-(4-Chloro-benz-yloxy)-2-phenyl-ethyl]-1H-benzotriazole.
Acta Crystallogr Sect E Struct Rep Online. 2010 May 8;66(Pt 6):o1246-7. doi: 10.1107/S1600536810015692.
4
Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
5
A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.
10
Regiospecific synthesis of 4-(2-oxoalkyl)pyridines.
Org Lett. 2001 Sep 6;3(18):2807-9. doi: 10.1021/ol010116f.

文献AI研究员

20分钟写一篇综述,助力文献阅读效率提升50倍。

立即体验

用中文搜PubMed

大模型驱动的PubMed中文搜索引擎

马上搜索

文档翻译

学术文献翻译模型,支持多种主流文档格式。

立即体验