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7-氯-1,5-二炔丙基-1H-1,5-苯并二氮杂卓-2,4(3H,5H)-二酮

7-Chloro-1,5-dipropargyl-1H-1,5-benzodiazepine-2,4(3H,5H)-dione.

作者信息

Dardouri Rachid, Kandri Rodi Youssef, Saffon Natalie, Essassi El Mokhtar, Ng Seik Weng

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Nov 20;66(Pt 12):o3228. doi: 10.1107/S1600536810047008.

Abstract

The seven-membered ring of the title compound, C(15)H(11)ClN(2)O(2), adopts a boat-shaped conformation (with the C atoms of the fused-ring as the stern and the methyl-ene C atom as the prow). The N atoms exists in a trigonal-planar coordination; one of the acetyl-enic H atoms forms a C-H⋯O hydrogen bond to the O atom of an adjacent mol-ecule, generating a linear chain along a body diagonal.

摘要

标题化合物C(15)H(11)ClN(2)O(2)的七元环呈船形构象(稠环的C原子为船尾,亚甲基C原子为船头)。N原子呈三角平面配位;其中一个乙炔基H原子与相邻分子的O原子形成C-H⋯O氢键,沿体对角线形成一条线性链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b8c1/3011384/e0c3cddf6f8d/e-66-o3228-fig1.jpg

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