Wang Xing, Liu Chun-Bo, Yan Yong-Sheng, Wang Shen-Tang, Liu Ling
School of Chemistry and Chemical Engineering, Jiangsu University, Zhenjiang 212013, People's Republic of China.
Acta Crystallogr Sect E Struct Rep Online. 2012 Feb 1;68(Pt 2):m153. doi: 10.1107/S160053681200102X. Epub 2012 Jan 14.
The title compound, [Cu(4)Br(4)(C(21)H(22)Br(2)N(4))(4)], features a macrocyclic Cu(4)L(4) ring system in which each Cu(I) atom is coordinated by one bromide ion and two N atoms from two 2,2'-dimethyl-1,1'-[2,2-bis-(bromo-meth-yl)propane-1,3-di-yl]di(1H-benzimidazole) (L) ligands in a distorted trigonal-planar geometry. The L ligands adopt either a cis or trans configuration. The asymmetric unit contains one half-mol-ecule with the center of the macrocycle located on a crystallographic center of inversion. Each bromide ion binds to a Cu(I) atom in a terminal mode and is oriented outside the ring. The macrocycles are inter-connected into a two-dimensional network by π-π inter-actions between benzimid-azole groups from different rings [centroid-centroid distance = 3.803 (5) Å.
标题化合物[Cu₄Br₄(C₂₁H₂₂Br₂N₄)₄]具有一个大环Cu₄L₄环体系,其中每个Cu(I)原子由一个溴离子以及来自两个2,2'-二甲基-1,1'-[2,2-双(溴甲基)丙烷-1,3-二亚基]二(1H-苯并咪唑)(L)配体的两个N原子配位,呈扭曲的三角平面几何构型。L配体采取顺式或反式构型。不对称单元包含半个分子,大环中心位于一个晶体学倒转中心上。每个溴离子以末端模式与一个Cu(I)原子结合,并朝向环外。大环通过来自不同环的苯并咪唑基团之间的π-π相互作用连接成二维网络[质心-质心距离 = 3.803 (5) Å]。