Mathematical analysis and molecular descriptors of two novel metal–organic models with chemical applications

Metal–Organic Networks (MONs) are made by chemical molecules that contain metal ions and organic ligands. A crystalline porous solid called Metal–Organic Networks (MONs) is made up of a 3 D metal network of ions held in place by a multidentate ligand. (MONs) can be used for gas storage, purification...

Full description

Saved in:
Bibliographic Details
Published inScientific reports Vol. 13; no. 1; p. 5314
Main Authors Zaman, Shahid, Jalani, Mehwish, Ullah, Asad, Ahmad, Wakeel, Saeedi, Ghulamullah
Format Journal Article
LanguageEnglish
Published London Nature Publishing Group UK 31.03.2023
Nature Publishing Group
Nature Portfolio
Subjects
639/638/563/606
639/638/563/983
639/638/630
639/705/1041
Catalysis
Chemical compounds
Chemistry
Comparative analysis
Drug delivery
Humanities and Social Sciences
Ligands
Mathematical analysis
Mathematical models
Metal ions
Metals
multidisciplinary
Science
Science (multidisciplinary)
Zinc oxides
Online AccessGet full text

Cover

More Information
Summary:Metal–Organic Networks (MONs) are made by chemical molecules that contain metal ions and organic ligands. A crystalline porous solid called Metal–Organic Networks (MONs) is made up of a 3 D metal network of ions held in place by a multidentate ligand. (MONs) can be used for gas storage, purification drug delivery, gas separation, catalysis, and sensing applications. There is enormous potential for effective integration and research of MONs in diverse applications. Molecular descriptors are arithmetic measures that reveal a chemical substance's physical and chemical characteristics in its foundational network in a natural relationship. They demonstrate an important role in theoretical and ecological chemistry, and in the field of medicine. In this research, we calculated various recently discovered molecular descriptors viz. the modified version of second zagreb index, harmonic index, reciprocal randic index, modified version of forgotten topological index, redefined first zagreb topological index, redefined second zagreb topological index and redefined third zagreb topological index for two separate metal–organic networks. The numerical and graphical comparative analysis of these considered molecular descriptors are also performed.
Bibliography:ObjectType-Article-1
SourceType-Scholarly Journals-1
ObjectType-Feature-2
content type line 23
ISSN:2045-2322
2045-2322
DOI:10.1038/s41598-023-32347-4