Zagreb Topological Properties of Hexa Organic Molecular Structures.

BACKGROUND

In connection with the study of chemical graph theory, it has been explored that a single number can capture the numerical representation of a molecular structure, and this number is known as a topological property (index).

OBJECTIVE

This study aimed to explore a few Zagreb topological properties for four hexa organic molecular structures (hexagonal, honeycomb, silicate, and oxide) based on the valency and valency sum of atoms in the structure.

METHODS

We employed the technique of partitioning the set of bonds according to the valency and valency-sum of end atoms of each bond and then performed the computation by using combinatorial rules of counting (that is, the rule of sum and the rule of product). The obtained results were also compared numerically and graphically.

RESULTS AND CONCLUSION

Exact values of five valencies based and five valency-sum-based Zagreb topological properties were found for the underline chemical structures.