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三水合(2,9-二甲基-1,10-菲啰啉)(4-羟基吡啶-2,6-二甲酸根)铜(II)

(2,9-Dimethyl-1,10-phenanthroline)(4-hydroxy-pyridine-2,6-dicarboxyl-ato)copper(II) trihydrate.

作者信息

Soleimannejad Janet, Aghabozorg Hossein, Manteghi Faranak, Najafi Shokoh

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Jun 13;65(Pt 7):m761-2. doi: 10.1107/S1600536809021588.

Abstract

In the title complex, [Cu(C(7)H(3)NO(5))(C(14)H(12)N(2))]·3H(2)O, there are two independent neutral mol-ecules of the Cu complex along with six mol-ecules of water of hydration in the asymmetric unit. The Cu(II )atoms in each complex adopt a distorted square-pyramidal coordination geometry being penta-coordinated by one N and two O atoms of 4-hydroxy-pyridine-2,6-dicarboxyl-ate anions and two N atoms of 2,9-dimethyl-1,10-phenanthroline (dmp) molecules. In the crystal structure, there are O-H⋯O and C-H⋯O hydrogen bonds and five π-π stacking inter-actions with centroid-centroid distances in the range 3.620 (1)-3.712 (1) Å. In addition, a C-H⋯π inter-action between a heterocyclic ring of dmp is observed to reinforce the crystal cohesion.

摘要

在标题配合物[Cu(C₇H₃NO₅)(C₁₄H₁₂N₂)]·3H₂O中,不对称单元中有两个独立的铜配合物中性分子以及六个结晶水分子。每个配合物中的Cu(II)原子采用扭曲的四方锥配位几何构型,由4-羟基吡啶-2,6-二羧酸根阴离子的一个N原子和两个O原子以及2,9-二甲基-1,10-菲啰啉(dmp)分子的两个N原子进行五配位。在晶体结构中,存在O—H⋯O和C—H⋯O氢键以及五个质心间距在3.620 (1) - 3.712 (1) Å范围内的π-π堆积相互作用。此外,观察到dmp杂环之间的C—H⋯π相互作用增强了晶体的内聚力。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f25d/2969473/f34bf9736079/e-65-0m761-fig1.jpg

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