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(1E,4E)-1,5-双[4-(二乙氨基)苯基]戊-1,4-二烯-3-酮

(1E,4E)-1,5-Bis[4-(di-ethyl-amino)-phen-yl]penta-1,4-dien-3-one.

作者信息

Ruanwas Pumsak, Chantrapromma Suchada, Ghabbour Hazem A, Fun Hoong-Kun

机构信息

Department of Chemistry and Center of Excellence for Innovation in Chemistry, Faculty of Science, Prince of Songkla University, Hat-Yai, Songkhla 90112, Thailand.

Department of Chemistry, Faculty of Science, Prince of Songkla University, Hat-Yai, Songkhla 90112, Thailand.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2014 Apr 26;70(Pt 5):o589-90. doi: 10.1107/S1600536814008356. eCollection 2014 May 1.

Abstract

There are two crystallograpically independent mol-ecules in the asymmetric unit of the title bis-chalcone derivative, C25H32N2O. Both mol-ecules are twisted with a dihedral angle between the two substituted benzene rings of 11.19 (16)° in one mol-ecule and 14.40 (15)° in the other. The central penta-1,4-dien-3-one fragments make dihedral angles of 8.49 (17) and 4.26 (17)° with the two adjacent benzene rings in one mol-ecule, whereas the corresponding values are 8.42 (16) and 6.18 (16)° in the other. In the crystal, mol-ecules are arranged into chains along the c-axis direction. Adjacent chains are inter-linked by weak inter-molecular C-H⋯O inter-actions. The crystal is further stabilized by C-H⋯π inter-actions.

摘要

在标题双查尔酮衍生物C25H32N2O的不对称单元中有两个晶体学独立的分子。两个分子均呈扭曲状,其中一个分子中两个取代苯环之间的二面角为11.19 (16)°,另一个分子中为14.40 (15)°。中心戊-1,4-二烯-3-酮片段与一个分子中的两个相邻苯环形成的二面角分别为8.49 (17)°和4.26 (17)°,而在另一个分子中相应的值分别为8.42 (16)°和6.18 (16)°。在晶体中,分子沿c轴方向排列成链。相邻的链通过弱分子间C-H⋯O相互作用相互连接。晶体通过C-H⋯π相互作用进一步稳定。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/a4f4/4011286/d5b50bae2695/e-70-0o589-fig1.jpg

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