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1-{2-苯基-2-[4-(三氟甲基)-苄氧基]乙基}-1H-苯并咪唑

1-{2-Phenyl-2-[4-(trifluoro-meth-yl)-benzyl-oxy]eth-yl}-1H-benzimidazole.

作者信息

Ozel Güven Ozden, Erdoğan Taner, Coles Simon J, Hökelek Tuncer

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2008 Jul 31;64(Pt 8):o1655-6. doi: 10.1107/S1600536808024033.

DOI:10.1107/S1600536808024033
PMID:21203341
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2962243/
Abstract

The asymmetric unit of the crystal structure of the title compound, C(23)H(19)F(3)N(2)O, contains two independent mol-ecules. In the two mol-ecules the planar benzimidazole ring systems are oriented with respect to the phen-yl/trifluoro-methyl-benzene rings at dihedral angles of 9.62 (6)/78.63 (7) and 2.53 (8)/83.83 (9)°. In the crystal structure, inter-molecular C-H⋯N hydrogen bonds link the mol-ecules into R(2) (2)(6) dimers. The mol-ecules are elongated along [001] and stacked along the b axis.

摘要

标题化合物C(23)H(19)F(3)N(2)O的晶体结构不对称单元包含两个独立分子。在这两个分子中，平面苯并咪唑环系统相对于苯基/三氟甲基苯环的二面角分别为9.62 (6)/78.63 (7)和2.53 (8)/83.83 (9)°。在晶体结构中，分子间的C-H⋯N氢键将分子连接成R(2) (2)(6)二聚体。分子沿[001]方向伸长并沿b轴堆叠。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3d27/2962243/5c341e4ba4da/e-64-o1655-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3d27/2962243/be905002c9d3/e-64-o1655-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3d27/2962243/5c341e4ba4da/e-64-o1655-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3d27/2962243/be905002c9d3/e-64-o1655-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3d27/2962243/5c341e4ba4da/e-64-o1655-fig2.jpg

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