Some valency oriented molecular invariants of certain networks.

Some valency oriented molecular invariants of certain networks.
Comb Chem High Throughput Screen. 2020 Oct 20;:
Authors: Salman M, Ali F, Masood Ur Rehman, Khalid I
Abstract
BACKGROUND: The valency of an atom in a molecular structure is the number of its neighboring atoms. A large number of valency based molecular invariants have been conceived, which correlate certain physio-chemical properties like boiling point, stability, strain energy and many more of chemical compounds.
OBJECTIVE: Our aim is to study the valency based molecular invariants for four hexa chemical structures, namely hexagonal network, honeycomb network, oxide network and silicate sheet network.
METHOD: We use the technique of atom-bonds partition according to the valences of atoms to find results.
RESULTS: Exact values of valency-based molecular invariants, namely the Randić index, atom bond connectivity index, geometric arithmetic index, harmonic index, Zagreb indices, Zagreb polynomials, F-index and F-polynomial are found for four hexa chemical structures.
PMID: 33081681 [PubMed - as supplied by publisher]

Source: Combinatorial Chemistry and High Throughput Screening - October 20, 2020 Category: Chemistry Authors: Salman M, Ali F, Masood Ur Rehman, Khalid I Tags: Comb Chem High Throughput Screen Source Type: research