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一种新型羟基萘基磺酰胺三齿席夫碱与第一排晚期过渡金属(LTM)以及后过渡金属原子锌和镉的配位行为:晶体学与计算研究

Coordinative Behavior of a New Hydroxynaphthanyl Sulphonamide Tridentate Schiff Base Towards First Row Late Transition Metal (LTM) and Post-Transitional Metal Atoms Zn and Cd: A Crystallographic and Computational Study.

作者信息

Sánchez-Guirao Laura, Viqueira Joaquín, Silva López Carlos, García-Vázquez José A, Castro Jesús

机构信息

Departamento de Química Orgánica, Universidad de Vigo, 36310 Pontevedra, Galicia, Spain.

Departamento de Química Inorgánica, Universidad de Santiago de Compostela, 15782 Santiago de Compostela, Galicia, Spain.

出版信息

Molecules. 2025 Aug 29;30(17):3543. doi: 10.3390/molecules30173543.

Abstract

The electrochemical oxidation of anodic metal (cobalt, nickel, zinc or cadmium) in a cell containing an acetonitrile solution of the ligand (E)-N-(2-(((2-hydroxynaphthalen-1-yl)methylene)amino)phenyl)-4-methylbenzenesulphonamide (HL) affords complexes with the general formula [ML] (M = Co, Ni, Zn and Cd). Additionally, it was possible to obtain complexes with the general formula [MLL'] when L' = 2,2-bipyridine (2,2-bpy), 4,4-bipyridine (4-4'-bpy) or 1,10-phenanthroline (phen) was present in the electrolytic cell. All of the compounds obtained have been characterized via microanalysis, IR spectroscopy, mass spectrometry, UV-visible spectroscopy and, in the case of diamagnetic compounds, via H NMR spectroscopy. Further structural and electronic characteristics of these adducts have been obtained via DFT simulations. The compounds NEt[CoL] (), [NiL(HO)] (), [NiL(CHCN)(HO)] (), [NiL(4,4'-bpy)] (), [ZnL(MeOH)] () and ZnL(2,2'-bpy) () have been characterized via X-ray diffraction. In this paper, we present a detailed study of the different behavior of the above-mentioned ligand depending on the metal and/or the presence of ancillary ligands.

摘要

在含有配体(E)-N-(2-(((2-羟基萘-1-基)亚甲基)氨基)苯基)-4-甲基苯磺酰胺(HL)乙腈溶液的电池中,阳极金属(钴、镍、锌或镉)的电化学氧化可得到通式为[ML](M = Co、Ni、Zn和Cd)的配合物。此外,当电解池中存在L' = 2,2-联吡啶(2,2-bpy)、4,4-联吡啶(4,4'-bpy)或1,10-菲咯啉(phen)时,还可以得到通式为[MLL']的配合物。所有得到的化合物均通过微量分析、红外光谱、质谱、紫外-可见光谱进行了表征,对于抗磁性化合物,还通过核磁共振氢谱进行了表征。这些加合物的进一步结构和电子特性通过密度泛函理论(DFT)模拟获得。化合物NEt[CoL]()、[NiL(HO)]()、[NiL(CHCN)(HO)]()、[NiL(4,4'-bpy)]()、[ZnL(MeOH)]()和ZnL(2,2'-bpy)()已通过X射线衍射进行了表征。在本文中,我们详细研究了上述配体根据金属和/或辅助配体的存在而表现出的不同行为。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/d0d1/12430383/98f3559fd949/molecules-30-03543-g001.jpg

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