Chemists prefer to describe reactions in terms of the properties of isolated systems, chosen
to yield information on the behavior of a given reactant under perturbation by another …

The synergistic mechanism and the synergistic effect of oleic imidazoline (OIM) and l-
cysteine (CYS) as carbon steel corrosion inhibitors were studied by experimental and …

The theoretical description of charge distribution, and related properties, such as chemical
reactivity descriptors of chemical compounds, has greatly benefited from the development of …

In the 1970s, Density Functional Theory (DFT) was borrowed from physics and adapted to
chemistry by a handful of visionaries. Now chemical DFT is a diverse and rapidly growing …

The new azo acetyl coumarin derivatives were synthesized and characterized using Fourier-
transform infrared spectroscopy (FTIR), proton nuclear magnetic resonance (1 H NMR) and …

In a previous study, the 1-(4-fluorobenzyl)-5-bromolindolin-2, 3‑dione (FBID) molecule was
synthesized by adding isatin and K 2 CO 3 to acetonitrile, followed by the addition of 4 …

The corrosion inhibition of mild steel in 1.0 M HCl solution by some selected imidazolium-
based ionic liquids, namely 1-propyl-3-methylimidazolium bis (trifluoromethyl-sulfonyl) imide …

Two heterocyclic compounds named 2, 6-diaminopyrimidin-4-ylnaphthalene-2-sulfonate (A)
and 2, 6-diaminopyrimidin-4-yl4-methylbenzene sulfonate (B) were synthesized. The …

The Density Functional Theory (DFT) and ab initio (HF and MP2) calculations were
performed on the quinoline molecule (QL) and its derivatives, namely quinaldine (QLD) and …

Abstract New synthesized coumarin-buta-1, 3-diene conjugated dyes having donor–
acceptor structure were prepared. The characterization of the synthesized dyes was …