Article ID: MTJPAM-D-22-00018

Title: A QSPR analysis for physical properties of lower alkanes involving Peripheral Wiener index


Montes Taurus J. Pure Appl. Math. / ISSN: 2687-4814

Article ID: MTJPAM-D-22-00018; Volume 4 / Issue 2 / Year 2022, Pages 81-85

Document Type: Research Paper

Author(s): Ruby Merlin Pinto a , Rangaswamy Rajendra b , Polaepalli Siva Kota Reddy c , Ismail Naci Cangul d

aDepartment of Mathematics, Mangalore University, Mangalagangothri, Mangalore-574 199, India

bDepartment of Mathematics, Mangalore University, Mangalagangothri, Mangalore-574 199, India – Department of Mathematics, Field Marshal K.M. Cariappa College (A Constituent College of Mangalore University), Madikeri-571 201, India

cDepartment of Mathematics, Sri Jayachamarajendra College of Engineering, JSS Science and Technology University, Mysuru-570 006, India

dDepartment of Mathematics, Faculty of Arts and Science, Bursa Uludag University, 16059 Bursa, Turkey

Received: 26 April 2022, Accepted: 30 July 2022, Published: 30 September 2022.

Corresponding Author: Polaepalli Siva Kota Reddy (Email address: pskreddy@jssstuniv.in)

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Abstract

Establishing new relationships between the physical properties and the molecular structure of chemical compounds is very exciting. In this short paper, a QSPR analysis is carried for physical properties of lower alkanes involving Peripheral Wiener index, number of paths of length 3 and the number of vertices in molecular graphs and best multiple linear regression models are presented for boiling points, molar volumes, molar refractions, heats of vaporization, critical temperatures, critical pressures and surface tensions of lower alkanes.

Keywords: Topological index, Peripheral Wiener index

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