Litcius/Paper detail

Metallaaromaticity – a protean world

Ben Joseph R. Cuyacot, Zahra Badri, Abhik Ghosh, Cina Foroutan‐Nejad

2022Physical Chemistry Chemical Physics15 citationsDOIOpen Access PDF

Abstract

rings. Finally, the finding that relatively minor perturbations in the ligand environment of the metal can substantially influence the aromaticity of metallabenzenes and related molecules underscores the protean character of metallaaromaticity and the need for even wider-ranging investigations. Considering the conflicts between magnetic response and ground-state aromaticity criteria (energetic, structural, and electronic criteria), we propose that the term aromatic be used for labeling a molecule if and only if all criteria confirm aromaticity. In other words, neither magnetic nor ground-state criteria are necessary and sufficient conditions for labeling a molecule aromatic.

Topics & Concepts

AromaticityDiamagnetismMoleculeRing (chemistry)ChemistryChemical physicsComputational chemistryGround stateCharacter (mathematics)Ligand (biochemistry)Atomic orbitalPhysicsAtomic physicsMagnetic fieldQuantum mechanicsElectronOrganic chemistryMathematicsReceptorGeometryBiochemistrySynthesis and Properties of Aromatic CompoundsAdvanced Chemical Physics StudiesFullerene Chemistry and Applications