Comparisons Between Tridentate Bis(benzazoles)-pyridine and Bis(benzazoles)triazine Ligands: a Theoretical Study

Croatica Chemica Acta

Andoni, Mihaiela¹  Pătraşcu, Jenel Marian²  Simu, Georgeta Maria¹  Antal, Diana¹  Pop, Raluca¹  Şoica, Codruţa¹  Dehelean, Cristina Adriana¹ 

[1] University of Medicine and Pharmacy “Victor Babes�? Timisoara, Faculty of Pharmacy, E. Murgu Square 2, 300041 Timisoara, Romania;University of Medicine and Pharmacy “Victor Babes�? Timisoara, Faculty of Medicine, E. Murgu Square 2, 300041 Timisoara, Romania

关键词: benzimidazole;    benzothiazole;    metal complexes;    tridentate ligands;   

DOI  :  

学科分类：化学（综合）

来源: Croatica Chemica Acta

【 摘 要 】

Twelve bis(benzazole) structures with potential ligand character were investigated by means of computational chemistry. Global and local reactivity descriptors within DFT (Density Functional Theory) theory (Fukui functions, chemical...

【 授权许可】

Unknown