Quantum chemical study of thiaozole derivatives as corrosion inhibitors based on density functional theory

Quantum chemical and theoretical calculations were carried out in the present study of some thiaozole derivatives. Relationship between electronic parameters of thiaozole derivatives 5-benzylidene-2,4-dioxo tetrahydro1,3-thiazole (5-BDT) 5-(4′-isopropylbenzylidene)-2,4-dioxotetrahydro-1,3-thiazole (...

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Bibliographic Details
Main Authors: Burak Tüzün, Jeetendra Bhawsar
Format: Article
Language:English
Published: Elsevier 2021-02-01
Series:Arabian Journal of Chemistry
Subjects:
DFT
Online Access:http://www.sciencedirect.com/science/article/pii/S1878535220304883