Lin Dong

Fluorine substitution vs. central metal regulation: electronic properties and intrinsic reactivity of Au(iii)- and Ag(iii)-coordinated corroles from comprehensive DFT calculations

Corrole macrocycles have broad application prospects in optoelectronics and biomedicine, yet the combined effects of central trivalent metal ions and fluorinated electron-withdrawing substituents on their electronic structures remain insufficiently understood. In this work, four Au(iii)/Ag(iii)-coordinated corrole comp...