Banu Afshan, Begum Noor Shahina, Lamani Ravi S, Khazi I M
Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):o779. doi: 10.1107/S1600536811007343. Epub 2011 Mar 5.
In the title compound, C(17)H(11)BrFN(3)S, the imidazothia-diazole and bromo-phenyl rings are individually almost planar, with maximum deviations of 0.0215 (4) and 0.0044 (4) Å, respectively, and are inclined at an angle of 27.34 (3)° with respect to each other. The dihedral angle between the mean planes of the fluoro-benzyl and imidazothia-diazole rings is 79.54 (3)°. The crystal structure is stabilized by inter-molecular C-H⋯N inter-actions resulting in chains of mol-ecules along the b axis.
在标题化合物C₁₇H₁₁BrFN₃S中,咪唑并噻二唑环和溴苯环各自几乎呈平面状,最大偏差分别为0.0215 (4) Å和0.0044 (4) Å,且它们彼此间倾斜角度为27.34 (3)°。氟苄基环和咪唑并噻二唑环的平均平面之间的二面角为79.54 (3)°。晶体结构通过分子间C—H⋯N相互作用得以稳定,从而形成沿b轴的分子链。