Irregular topological indices of certain metal organic frameworks

It is interesting to study the molecular topology that provides a base for relationship of physicochemical property of a definite molecule. The topology of a molecule and the irregularity of the structure plays a vital character in shaping properties of the structure like enthalpy and entropy. In th...

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Main Authors: Chu Yu-Ming, Abid Muhammad, Qureshi Muhammad Imran, Fahad Asfand, Aslam Adnan
Format: Article
Language:English
Published: De Gruyter 2021-05-01
Series:Main Group Metal Chemistry
Subjects:
Online Access:https://doi.org/10.1515/mgmc-2021-0009
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author Chu Yu-Ming
Abid Muhammad
Qureshi Muhammad Imran
Fahad Asfand
Aslam Adnan
author_facet Chu Yu-Ming
Abid Muhammad
Qureshi Muhammad Imran
Fahad Asfand
Aslam Adnan
author_sort Chu Yu-Ming
collection DOAJ
description It is interesting to study the molecular topology that provides a base for relationship of physicochemical property of a definite molecule. The topology of a molecule and the irregularity of the structure plays a vital character in shaping properties of the structure like enthalpy and entropy. In this article, we are interested to calculate some irregular topological indices of two classes of metal organic frameworks (MOFs) namely BHT (Butylated hydroxytoluene) based metal (M = Co, Fe, Mn, Cr) organic frameworks (MBHT) and M1TPyP-M2 (TPyP = 5, 10, 15, 20-tetrakis (4-pyridyl) porphyrin and M1, M2, = Fe and Co) MOFs. Also we compare our results graphically.
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spelling doaj.art-f10143fe2a5a4f19bb3036195b7752602022-12-22T04:17:12ZengDe GruyterMain Group Metal Chemistry2191-02192021-05-01441738110.1515/mgmc-2021-0009Irregular topological indices of certain metal organic frameworksChu Yu-Ming0Abid Muhammad1Qureshi Muhammad Imran2Fahad Asfand3Aslam Adnan4Department of Mathematics, COMSATS University Islamabad, Vehari campus, Vehari61100, PakistanDepartment of Mathematics, Huzhou University, Huzhou313000, ChinaDepartment of Mathematics, COMSATS University Islamabad, Vehari campus, Vehari61100, PakistanDepartment of Mathematics, COMSATS University Islamabad, Vehari campus, Vehari61100, PakistanDepartment of Natural Sciences and Humanities, University of Engineering and Technology, Lahore, Pakistan (RCET), PakistanIt is interesting to study the molecular topology that provides a base for relationship of physicochemical property of a definite molecule. The topology of a molecule and the irregularity of the structure plays a vital character in shaping properties of the structure like enthalpy and entropy. In this article, we are interested to calculate some irregular topological indices of two classes of metal organic frameworks (MOFs) namely BHT (Butylated hydroxytoluene) based metal (M = Co, Fe, Mn, Cr) organic frameworks (MBHT) and M1TPyP-M2 (TPyP = 5, 10, 15, 20-tetrakis (4-pyridyl) porphyrin and M1, M2, = Fe and Co) MOFs. Also we compare our results graphically.https://doi.org/10.1515/mgmc-2021-0009topological descriptorsirregularity indiceschemical graph theorymetal organic frameworks
spellingShingle Chu Yu-Ming
Abid Muhammad
Qureshi Muhammad Imran
Fahad Asfand
Aslam Adnan
Irregular topological indices of certain metal organic frameworks
Main Group Metal Chemistry
topological descriptors
irregularity indices
chemical graph theory
metal organic frameworks
title Irregular topological indices of certain metal organic frameworks
title_full Irregular topological indices of certain metal organic frameworks
title_fullStr Irregular topological indices of certain metal organic frameworks
title_full_unstemmed Irregular topological indices of certain metal organic frameworks
title_short Irregular topological indices of certain metal organic frameworks
title_sort irregular topological indices of certain metal organic frameworks
topic topological descriptors
irregularity indices
chemical graph theory
metal organic frameworks
url https://doi.org/10.1515/mgmc-2021-0009
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