Suppr超能文献

1,1-双(4-氟苯基)-3,4-二氢-1H-1,3-恶嗪并[3,4-a]吲哚

1,1-Bis(4-fluoro-phen-yl)-3,4-dihydro-1H-1,3-oxazino[3,4-a]indole.

作者信息

Fu Weijun, Deng Dongsheng, Hong Dongfeng, Wang Zhiqiang, Ji Baoming

机构信息

College of Chemistry and Chemical Engineering, Luoyang Normal University, Luoyang 471022, People's Republic of China.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2008 Oct 31;64(Pt 11):o2227. doi: 10.1107/S160053680803376X.

Abstract

The title compound, C(23)H(17)F(2)NO, which crystallizes with two independent mol-ecules in the asymmetric unit, was prepared by the cyclization of 4-[2-bis-(4-fluoro-phen-yl)methyl-eneamino]but-3-yn-1-ol at room temperature. The mol-ecules display a tripod conformation. The two fluoro-phenyl rings make dihedral angles of 79.26 (2) and 85.87 (1)° [86.53 (1) and 83.67 (2)° in the second mol-ecule] with the indole ring, and the dihedral angles between the fluoro-phenyl rings are 67.74 (2) and 66.33 (2)°, respectively. Furthermore, the indole rings are located on the edge of the respective oxazine half-chair ring systems. Nonconventional C-H⋯π contacts between indole and fluoro-phenyl rings are observed.

摘要

标题化合物C(23)H(17)F(2)NO在不对称单元中由两个独立分子结晶而成,它是通过4-[2-双-(4-氟苯基)亚甲基氨基]丁-3-炔-1-醇在室温下环化制备的。分子呈三脚架构象。两个氟苯环与吲哚环的二面角分别为79.26 (2)和85.87 (1)°[第二个分子中为86.53 (1)和83.67 (2)°],氟苯环之间的二面角分别为67.74 (2)和66.33 (2)°。此外,吲哚环位于各自恶嗪半椅环系统的边缘。观察到吲哚环与氟苯环之间存在非常规的C-H⋯π接触。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/056d/2959698/139a7b3c0cc9/e-64-o2227-fig1.jpg

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