Chen Fang
Ordered Matter Science Research Center, College of Chemistry and Chemical Engineering, Southeast University, Nanjing 210096, People's Republic of China.
Acta Crystallogr Sect E Struct Rep Online. 2009 Jun 17;65(Pt 7):m788. doi: 10.1107/S1600536809022442.
In the title compound, [Fe(2)(C(5)H(5))(2)(C(20)H(16)N(8))], one of the unsubstituted cyclo-penta-diene (Cp) rings is disordered over two positions, with site-occupancy factors of 0.609 (19) and 0.391 (19). The dihedral angle formed by the benzene ring with the tetra-zole rings are 51.86 (15) and 3.76 (11)°. In the crystal structure, centrosymmetrically related mol-ecules are linked into dimers by inter-molecular C-H⋯N hydrogen-bonding inter-actions.
在标题化合物[Fe₂(C₅H₅)₂(C₂₀H₁₆N₈)]中,一个未取代的环戊二烯(Cp)环在两个位置上无序,占位因子分别为0.609 (19) 和0.391 (19)。苯环与四唑环形成的二面角分别为51.86 (15)°和3.76 (11)°。在晶体结构中,通过分子间C—H⋯N氢键相互作用,中心对称相关的分子连接成二聚体。