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99242 CORROSION INHIBIiTORS: CORRELATION BETWEEN CHEMICAL STRUCTURE AND EFFICIENCY

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Product Number: 51300-99242-SG
ISBN: 99242 1999 CP
Author: I. Lukovits, T. Kosztolanyi, E. Kalman and G. Palinkas
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Corrosion inhibition efficiencies of heterocyclic, aromatic or partially saturated aromatic compounds (pyrimidines, benzothiazole derivatives, amino-acids containing an aromatic part, pyridines and quinolines) were correlated with quantum chemical indices of the respective molecules. Inhibition efficiencies measured in acidic solutions containing 0.001 and 0.01 mol/L of the inhibitor, respectively, were collected. The quantum chemical calculations were done by using the simple Huckel method Comparison of inhibition efficiencies and the differences between energies of the highest occupied and the lowest unoccupied molecular orbitals... Kevwords: corrosion inhibitors, aromatic systems, quantum chemistry, pyrimidines, benzothiazole derivatives, amino-acids, pyridines, quinolines.
Corrosion inhibition efficiencies of heterocyclic, aromatic or partially saturated aromatic compounds (pyrimidines, benzothiazole derivatives, amino-acids containing an aromatic part, pyridines and quinolines) were correlated with quantum chemical indices of the respective molecules. Inhibition efficiencies measured in acidic solutions containing 0.001 and 0.01 mol/L of the inhibitor, respectively, were collected. The quantum chemical calculations were done by using the simple Huckel method Comparison of inhibition efficiencies and the differences between energies of the highest occupied and the lowest unoccupied molecular orbitals... Kevwords: corrosion inhibitors, aromatic systems, quantum chemistry, pyrimidines, benzothiazole derivatives, amino-acids, pyridines, quinolines.
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