Diamond lattice in single-component molecular crystals comprising tetrabenzoporphyrin neutral radicals

Chem Commun (Camb). 2024 Mar 12;60(22):3019-3022. doi: 10.1039/d3cc05948k.

Abstract

A single-component molecular radical crystal of CoIII(tbp˙-)(CN)2, where tbp = tetrabenzoporphyrinato ligand, exhibiting a diamond lattice was fabricated as a potential candidate for a three-dimensional Dirac electron system. Band structure calculations revealed that the Fermi energy level was located at the Dirac point. A small electrical resistivity of 160 Ω cm was observed at 2 K under the application of 2.4 GPa. Furthermore, substituting CoIII by FeIII or MnIII led to the introduction of local magnetic moments into the diamond-lattice system. MIII(tbp˙-)L2 crystals will open up uncharted fields in the study of the Dirac electron systems.