On Certain Degree Based and Bond Additive Molecular Descriptors of Hexabenzocorenene
Biointerface Research in Applied Chemistry · 2023
The molecular descriptor is the final number that comes from a numerical method that uses a picture of a structure to turn chemical information into a useful number. The structure-based investigations revealed a close link between topological structures and their physical practices, synthetic properties, and natural traits. Auxiliary descriptors of this type have been effectively used to improve understanding of sub-atomic structures. In this study, the atomic representations of three major classes of polycyclic aromatic hydrocarbons, such as hexa-peri-hexabenzocoronene, are used in a non-experimental graph-theoretic technique that yields the mathematical structural quantities of the substances under consideration.