Fu Weijun, Deng Dongsheng, Hong Dongfeng, Wang Zhiqiang, Ji Baoming
College of Chemistry and Chemical Engineering, Luoyang Normal University, Luoyang 471022, People's Republic of China.
Acta Crystallogr Sect E Struct Rep Online. 2008 Oct 31;64(Pt 11):o2227. doi: 10.1107/S160053680803376X.
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.
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。