Fig. 14

Optimized molecular structure and frontier molecular orbitals (HOMO and LUMO) of Tetra-Pz-Ortho and Tetra-Pz-Para, into protonated forms.

Optimized molecular structure and frontier molecular orbitals (HOMO and LUMO) of Tetra-Pz-Ortho and Tetra-Pz-Para, into protonated forms.