Browsing by Author "Martinez, Todd"

Absorption and fluorescence features of an amphiphillic meso-pyrimidinylcorrole: Experimental study and quantum chemical calculations

Origin of the individual basicity of rorrole NH-tautomers: A quantum chemical study o molecular structure and dynamics, kientics, and thermodynamics

Quantum chemical insights into the dependence of porphorin basicity on the meso-aryl substituents: thermodynamics, buckling, reaction sites and molecular flexibility