Chemical applicability and computation of K-Banhatti indices for benzenoid hydrocarbons and triazine-based covalent
M C Shanmukha1, Rashad Ismail2,3, K J Gowtham4
1Department of Mathematics, PES Institute of Technology and Management, Shivamogga, 577204, India.
Abstract:
The novel applications in chemistry include the mathematical models of molecular structure of the compounds which has numerous findings in this area that refers to mathematical chemistry. Topological descriptors play a major role in QSAR/QSPR studies that analyses the biological and physicochemical properties of the compounds. In the recent times, a new type of topological descriptors are proposed, called K-Banhatti indices. In this study the chemical applicability of K-Banhatti indices are examined for benzenoid hydrocarbons (derivatives of benzene). These indices have shown remarkable results through the study of statistical analysis. Subsequently, triazine-based covalent organic frameworks (CoF's) are studied for which [Formula: see text], [Formula: see text], [Formula: see text], [Formula: see text], [Formula: see text], [Formula: see text], and HB(G) of a graph G are computed.
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