机译:水溶性Cu-II-TEMPO催化剂在水中介导的好氧醇氧化机理:密度泛函理论研究
Inner Mongolia Univ Technol, Coll Chem Engn, Inner Mongolia Key Lab Theoret & Computat Chem Si, Hohhot 010051, Peoples R China;
Jilin Univ, Ctr High Performance Comp, Changchun 130022, Jilin, Peoples R China;
Alcohol Oxidation; C-H Activation; Density Functional Theory; Reaction Mechanism; BENZYLIC ALCOHOLS; 2-STATE REACTIVITY; EFFICIENT GREEN; COMPLEXES; DFT; COPPER(II); ALDEHYDES; INSIGHT; CYCLES; MODEL;