Catecholase activity investigations using in situ copper complexes continuing Schiff base derivatives with a theoretical calculation
作者: A. DjedouaniF. AbrigachM. KhoutoulA. MohamadouA. BendaasR. Touzani
刊名: Oriental Journal of Chemistry, 2015, Vol.31 (1)
来源数据库: Material Science Research India
DOI: 10.13005/ojc/310110
关键词: Schiff baseCatecholasecopper complexescatalystsemi-empirical methodAM1
原始语种摘要: The study of catecholase activity of a series of Schiff base compounds using in situ copper complexes of 4-hydroxy-6-methyl-3-(1-(phenylimino)ethyl)-2H-pyran-2-one derivatives has been reported. The reaction rate depends on four parameters: The nature of the substitution in para position to the benzene ring, the nature of counter anion, the concentration of ligand and the nature of solvent. The highest rate activity is given by complex resulting from one equivalent of ligand L2 and two equivalents of copper acetate in methanol, which equal to 62.25 µmol.min-1.L-1.In other part, a theoretical study of such ligands using the semi-empirical method AM1 were also investigated. A good relationship founded between the maximal reaction rate (Vmax) and the HOMO energy (Pearson correlation:...
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关键词翻译
关键词翻译
  • theoretical 理论的
  • derivatives 派生物
  • complexes 联合企业
  • reaction 反酌
  • activity 活度
  • pyran 吡喃
  • copper 
  • benzene 
  • anion 阴离子
  • maximal 最大的