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水合 -(2,2'-联吡啶 -κN,N')双 -(噻吩 -2 -羧酸根 -κO)铜(II)

Aqua-(2,2'-bipyridine-κN,N')bis-(thio-phene-2-carboxyl-ato-κO)copper(II).

作者信息

Mahmoud Reda F, Janiak Christoph

机构信息

Institut für Anorganische und Analytische Chemie, Universität Freiburg, Albertstrasse 21, D-79104 Freiburg, Germany.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Jul 11;65(Pt 8):m909-10. doi: 10.1107/S1600536809026713.

Abstract

In the title complex, [Cu(C(5)H(3)O(2)S)(2)(C(10)H(8)N(2))(H(2)O)], the Cu(II) atom is in a distorted square-pyramidal environment, with an Addison τ parameter of 0.07. The coordination geometry is defined by two nitro-gen donors from the 2,2'-bipyridine ligand, two O atoms from two monodentate thio-phene-2-carboxyl-ate ligands and one O atom from the aqua ligand. The latter occupies the elongated apical position. This is different from the related structure of aqua-(1,10-phenanthroline)bis-(thio-phene-2-carboxyl-ato)copper(II) where a carboxyl-ate O atom is in the apical position [Feng et al. (2005 ▶). Z. Kristallogr. New Cryst. Struct.220, 429-430]. The uncoordinated carboxyl-ate O atoms form intra- and inter-molecular hydrogen bonds to the aqua ligand. Two neighbouring 2,2'-bipyridine ligands form a π-stack, with a centroid-centroid distance of 3.683 (2) Å.

摘要

在标题配合物[Cu(C₅H₃O₂S)₂(C₁₀H₈N₂)(H₂O)]中,Cu(II)原子处于扭曲的四方锥环境中,Addison τ参数为0.07。配位几何结构由2,2'-联吡啶配体的两个氮供体、两个单齿噻吩-2-羧酸酯配体的两个O原子以及水配体的一个O原子定义。后者占据拉长的顶端位置。这与水合-(1,10-菲咯啉)双-(噻吩-2-羧酸根)铜(II)的相关结构不同,在该结构中一个羧酸根O原子处于顶端位置[Feng等人(2005 ▶)。《晶体学报.新晶体结构》220, 429 - 430]。未配位的羧酸根O原子与水配体形成分子内和分子间氢键。两个相邻的2,2'-联吡啶配体形成一个π堆积,质心-质心距离为3.683 (2) Å。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/329e/2977207/cf46e9932731/e-65-0m909-fig1.jpg

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