Fu Jun-Dan, Zhang Chun-Yan, Shi Qing-Yu, Wen Yi-Hang
Zhejiang Key Laboratory for Reactive Chemistry on Solid Surfaces, Institute of Physical Chemistry, Zhejiang Normal University, Jinhua, Zhejiang 321004, People's Republic of China.
Acta Crystallogr Sect E Struct Rep Online. 2010 Jul 24;66(Pt 8):m1003-4. doi: 10.1107/S1600536810028497.
In the centrosymmetric dinuclear title complex, [Cu(2)(C(12)H(6)O(4))(2)(C(3)H(7)NO)(4)(H(2)O)(2)], the coordination environment of each Cu(II) atom displays a distorted CuO(5) square-pyramidal geometry, which is formed by two carboxyl-ate O atoms of two μ-1,8-nap ligands (1,8-nap is naphthalene-1,8-dicarboxyl-ate), two O atoms of two DMF (DMF is N,N'-dimethyl-formamide) and one coordinated water mol-ecule. The Cu-O distances involving the four O atoms in the square plane are in the range 1.9501 (11)-1.9677 (11) Å, with the Cu atom lying nearly in the plane [deviation = 0.0726 (2) Å]. The axial O atom occupies the peak position with a Cu-O distance of 2.885 (12) Å, which is significantly longer than the rest of the Cu-O distances. Each 1,8-nap ligand acts as bridge, linking two Cu(II) atoms into a dinuclear structure. Inter-molecular O-H⋯O and C-H⋯O hydrogen-bonding inter-actions consolidate the structure.
在中心对称的双核标题配合物[Cu₂(C₁₂H₆O₄)₂(C₃H₇NO)₄(H₂O)₂]中,每个Cu(II)原子的配位环境呈现出扭曲的CuO₅四方锥几何构型,它由两个μ-1,8-萘配体(1,8-萘即萘-1,8-二甲酸根)的两个羧酸根O原子、两个N,N'-二甲基甲酰胺(DMF)的两个O原子以及一个配位水分子形成。在四方平面中涉及四个O原子的Cu - O距离在1.9501 (11) - 1.9677 (11) Å范围内,Cu原子几乎位于该平面内[偏差 = 0.0726 (2) Å]。轴向O原子占据峰值位置,Cu - O距离为2.885 (12) Å,这明显长于其余的Cu - O距离。每个1,8-萘配体作为桥连,将两个Cu(II)原子连接成双核结构。分子间的O - H⋯O和C - H⋯O氢键相互作用巩固了该结构。