Saikat Sarkar, Avijit Sarkar, Y. Aydogdu, F. Dagdelen, Sougata Sarkar, Krishna Chattopadhyay
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引用次数: 0
摘要
通过元素分析、光谱分析、摩尔电导和磁矩测量,合成了一种新的 1,10-菲罗啉离子铜(II)配合物,并对其结构进行了表征。此外,还通过单晶 X 射线衍射分析研究了该复合物的晶体结构,结果表明铜(II)周围存在扭曲的八面体几何结构,其中来自 1,10- 菲罗啉的一个 N 原子和来自三个 H2O 分子的三个 O 原子占据基面,而另一个 Nphen 原子和一个 Cl 原子则位于顶端位置。因此,分子中存在的三个配位水和氯基,以及反氯离子和结晶水是造成广泛氢键的原因。因此,该复合物形成了一个巨大的三维氢键网络。分子间的 O-H-Cl 和 O-H-O 两种类型的氢键通过 π-π 相互作用的支撑物在晶体堆积和合理的导电机制中发挥了关键作用。此外,还测量了该复合物的导电性和光学特性,结果表明其具有半导体性质,光带隙(Egd)值为 1.23 eV。
Synthesis, X-Ray Crystal Structure, Solid State Electrical and Optical Properties of New Copper(II) Complex with 1,10-Phenanthroline Ligand
A new ionic copper(II) complex of 1,10-phenanthroline was synthesized and structurally characterized by elemental and spectroscopic analyses, molar conductance and magnetic moment measurements. The crystal structure of complex was also investigated through single crystal X-ray diffraction analysis and suggestted a distorted octahedral geometry around copper(II), where one N atom from 1,10-phenanthroline and three O atoms from three H2O molecules occupying the basal plane while another Nphen and one Cl atom remain at the apical positions. Thus, the presence of three coordinated waters and chloride group along with the counter chloride ion and water of crystallization is responsible for extensive hydrogen bonding present in the molecule. Thus, the complex forms a 3D gigantic H-bonded network. The two types of intermolecular O–H···Cl and O–H···O hydrogen bonding play the pivotal role in crystal packing and plausible conductivity mechanism through the π-π interacting supports. The electrical conductivity and optical properties were also measured and the results focus on the semiconducting nature of the complex with optical band gap (Egd) value 1.23 eV.