The cocrystal 10-(2-methyl-4-phenyl-1H-inden-6-yl)-10H-phenothiazine-10-(2-methyl-7-phenyl-1H-inden-5-yl)-10H-phenothiazine (0.54/0.46)

被引:1
|
作者
Nikulin, Mikhail V. [2 ]
Voskoboynikov, Alexander Z. [2 ]
Suponitsky, Kyrill Yu. [1 ]
机构
[1] Russian Acad Sci, AN Nesmeyanov Organoelement Cpds Inst, Moscow 119991, Russia
[2] Moscow MV Lomonosov State Univ, Moscow 119992, Russia
关键词
D O I
10.1107/S1600536808036210
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The title compound, 0.535C(28)H(21)NS.0.465C(28)H(21)NS, was synthesized by palladium-catalysed amination. The structure is composed of two isomeric molecules, viz. 10-(2-methyl-4-phenyl-1H-inden-6-yl)-10H-phenothiazine, and 10-(2-methyl-7-phenyl-1H-inden-5-yl)-10H-phenothiazine, in the refined ratio 0.535 (12):0.465 (12). The isomers differ by the localization of the double bond in the cyclopentadiene ring. There are two sites in the structure that are occupied by the isomers. The respective isomers are occupationally disordered in each site, the refined proportions being 0.640 (6):0.360 (6) and 0.43 (1):0.57 (1). Moreover, each isomeric molecule is chiral; due to the crystallographic centres of symmetry, the molecules are also present in enantiomeric pairs. The crystal structure is stabilized by weak pi-pi [C center dot center dot center dot C = 3.389 (2) angstrom] interactions.
引用
收藏
页码:O2317 / U2137
页数:16
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