Phenolic acid derivatives with potential anticancer properties––a structure–activity relationship study. Part 1: Methyl, propyl and octyl esters of caffeic and gallic acids

SM Fiuza, C Gomes, LJ Teixeira, MTG Da Cruz… - Bioorganic & medicinal …, 2004 - Elsevier
The antiproliferative and cytotoxic properties of polyphenolic acid derivatives, structurally
related with the natural models caffeic and gallic acids, have been tested in human cervix …

Electrochemical and computational aspects of surface interaction and corrosion inhibition of mild steel in hydrochloric acid by Phyllanthus amarus leaf extract (PAE)

KK Anupama, K Ramya, A Joseph - Journal of Molecular Liquids, 2016 - Elsevier
Phyllanthus amarus leaf extract (PAE) has been investigated as a corrosion inhibitor for mild
steel in 1 M hydrochloric acid. Electrochemical impedance spectroscopy and …

DFT study of new bipyrazole derivatives and their potential activity as corrosion inhibitors

H Wang, X Wang, H Wang, L Wang, A Liu - Journal of Molecular Modeling, 2007 - Springer
In the present work, a theoretical study of five bipyrazolic-type organic compounds, 4-{bis [(3,
5-dimethyl-1 H-pyrazolyl-1-yl) methyl]-amino} phenol (1), N 1, N 1-bis [(3, 5-dimethyl-1 H …

Experimental and theoretical study of the effect of some heterocyclic compounds on the corrosion of low carbon steel in 3.5% NaCl medium

M Şahin, G Gece, F Karcı, S Bilgiç - Journal of Applied Electrochemistry, 2008 - Springer
The efficiency of three heterocyclic compounds, 3-amino-1, 2, 4-triazole, 4-hydroxy-2H-1-
benzopyran-2-one and 4-hydroxy-3-(1H-1, 2, 4-triazole-3-ylazo)-2H-1-benzopyran-2-one …

DFT studies of pyridine corrosion inhibitors in electrical double layer: solvent, substrate, and electric field effects

M Lashkari, MR Arshadi - Chemical physics, 2004 - Elsevier
The molecular behavior of some pyridine derivatives as corrosion inhibitors of iron and
aluminum in acid media, were studied quantum electrochemically. The calculations were …

The solubility of copper in high-temperature magmatic vapors: a quest for the significance of various chloride and sulfide complexes

Z Zajacz, JH Seo, PA Candela, PM Piccoli… - … et Cosmochimica Acta, 2011 - Elsevier
We conducted experiments to determine the effect of various chemical components (NaCl,
KCl, HCl, FeCl2, H2S, SO2) on the solubility of Cu in single phase aqueous vapors at 1000° …

QSAR study on N-containing corrosion inhibitors: Quantum chemical approach assisted by topological index

SG Zhang, W Lei, MZ Xia, FY Wang - Journal of Molecular Structure …, 2005 - Elsevier
In this paper, QSAR study on N-containing corrosion inhibitors has been made using
quantum chemical approach assisted by a novel topological index (Xv# 2). Two models …

[图书][B] Relativistic Theory of Atoms and Molecules III: A Bibliography 1993–1999

P Pyykkö - 2013 - books.google.com
Relativistic effects are of major importance for understanding the properties of heavier atoms
and molecules. Volumes I-III of Relativistic Theory of Atoms and Molecules constitute the …

Theoretical investigation of corrosion inhibition effect of imidazole and its derivatives on mild steel using cluster model

M Mousavi, M Mohammadalizadeh, A Khosravan - Corrosion science, 2011 - Elsevier
Interaction energies of imidazole and its seven derivatives on the surface of mild steel were
calculated via a cluster model by using quantum chemical calculations at density functional …

[PDF][PDF] A combined experimental and theoretical study on the corrosion inhibition and adsorption behaviour of quinoxaline derivative during carbon steel corrosion in …

H Zarrok, A Zarrouk, R Salghi, H Oudda… - Port Electrochim …, 2012 - peacta.org
The corrosion inhibitive effects of 2-(4-methylphenyl)-1, 4-dihydroquinoxaline (Q1) on
carbon steel surface in hydrochloric acid solution was studied using weight loss …