Circumcoronene Nanostructures with Cavity and its Novel Molecular Descriptors

Abstract

A topological descriptor is a mathematical value related with chemical structure for relationship of chemical structure with a variety of physical properties, chemical reactivity otherwise biological activity. Quantitative structure activity and structure property relation of chemical structure need expressions intended for the topological property of these structures. In this paper, we present the exact expression for various molecular bond additive descriptors for circumcoronene and hexa-peri-hexabenzocoronene Nanostructures with cavity.