Electrochemistry, photoluminescence and theoretical study of the first 5,10,15,20-tetra-(4-(triazol-1-yl)phenyl) porphyridine complex

Abstract

The first 5,10,15,20-tetra-(4-(triazol-1-yl)phenyl) porphyridine complex, [Zn[Formula: see text]Cl[Formula: see text](5,10,15,20-tetra-(4-(triazol-1-yl)phenyl)porphyridine)][Formula: see text]Cl•[Formula: see text]H[Formula: see text]O•7[Formula: see text]H[Formula: see text]O (1) has been synthesized via solvothermal reactions and characterized by single-crystal X-ray diffraction. Complex 1 is characteristic of a one-dimensional (1-D) structure, consisting of neutral [Zn[Formula: see text]Cl[Formula: see text](5,10,15,20-tetra-(4-(triazol-1-yl)phenyl) porphyridine)][Formula: see text] chains, isolated chloride ions and lattice water molecules. The zinc ion is in a four-coordinated tetrahedral geometry, and the porphyrin macrocycle is saddle-distorted. Photoluminescence measurement with solid-state samples discovers that it exhibits an emission in the green region of the light spectrum. Time-dependent density functional theory (TDDFT) calculation discovers that this emission can be attributed to the [Formula: see text]–[Formula: see text]* charge transfer. The cyclic voltammetry (CV) measurement reveals that it possesses an oxidation peak at 0.37 V.