التفاصيل البيبلوغرافية
| العنوان: |
On Some Topological Indices of Metal-Organic Frameworks. |
| المؤلفون: |
Yu, Yun, Khalid, Asma, Aamir, Muhammad, Siddiqui, Muhammad Kamran, Muhammad, Mehwish Hussain, Bashir, Yasir |
| المصدر: |
Polycyclic Aromatic Compounds; 2023, Vol. 43 Issue 6, p5607-5628, 22p |
| مصطلحات موضوعية: |
MOLECULAR connectivity index, METAL-organic frameworks, MOLECULAR structure, PHYSICAL & theoretical chemistry, ENVIRONMENTAL chemistry, METALLOPORPHYRINS |
| مصطلحات جغرافية: |
ZAGREB (Croatia) |
| مستخلص: |
Topological indices are very important because they are used in the study of QSAR (Quantitative Structure–Activity Relationships) and QSPR (Quantitative Structure–Property Relationships) which are mathematical models that show the properties among physicochemical, environmental, and biological activity of a chemical structure. The chemical structure of a molecular graph is used to find the topological indices, which are widely used in theoretical chemistry, environmental chemistry, toxicology, and many others for correlation analysis. Topological indices are numerical values that helps us in measuring the physical and chemical properties of any molecule. In this article, we have calculated some degree-based topological indices of two categories of Metal-Organic Frameworks (MOFs), named as, CoBHT (cobalt butylated hydroxytoluene) and FeTPyP (Iron tetrakis pyridyl porphyrin)-CO (MOFs), also their graphical results are compared at the end. [ABSTRACT FROM AUTHOR] |
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| قاعدة البيانات: |
Complementary Index |
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