Crystal structure of 1-butyl-3-{2-[(indan-5-yl)amino]-2-oxoethyl}-1H-imidazol-3-ium chloride

被引:1
|
作者
Zende, Vidya [1 ]
Girase, Tejpalsingh Ramsingh [1 ]
Chrysochos, Nicolas [2 ]
Kapdi, Anant Ramakant [1 ]
Schulzke, Carola [2 ]
机构
[1] Inst Chem Technol, Dept Chem, Nathalal Parekh Rd, Bombay 400019, Maharashtra, India
[2] Ernst Moritz Arndt Univ Greifswald, Inst Biochem, Felix Hausdorff Str 4, D-17487 Greifswald, Germany
来源
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2018年 / 74卷
基金
欧洲研究理事会;
关键词
crystal structure; N-heterocyclic carbenes; imidazolium salt; amido-functionalization; electron-rich ligand; sigma donor acetamide; hydrogen bonding;
D O I
10.1107/S2056989018014792
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
In the cation of the title molecular salt, C18H24N3O+center dot Cl-, an intramolecular C-H center dot center dot center dot O hydrogen bond stabilizes the almost coplanar orientation of the aromatic ring of the indane unit and the amide plane. In the crystal, the packing is dominated by intermolecular C-H center dot center dot center dot Cl hydrogen-bonding interactions that result in the formation of slab-like structures propagating along [010]. The slabs are linked by weak C-H center dot center dot center dot O interactions, forming layers lying parallel to (100). The methylene carbon atom of the indanyl substituent is disordered over two positions with a refined occupancy ratio of 0.84 (2):0.16 (2). The crystal studied was refined as a twin with matrix [1 0 0.9, 0 (1) over bar 0, 0 0 (1) over bar]; the resulting BASF value is 0.30.
引用
收藏
页码:1665 / +
页数:8
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