Experimental and Theoretical Study of Corrosion Inhibition of Mild Steel in 1.0 M HCl Medium by 2(-4( hloro phenyl-1H- benzo[d]imidazol)-1-yl)phenyl)methanone
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https://figshare.com/articles/dataset/Experimental_and_Theoretical_Study_of_Corrosion_Inhibition_of_Mild_Steel_in_1_0_M_HCl_Medium_by_2_-4_hloro_phenyl-1H-_benzo_d_imidazol_-1-yl_phenyl_methanone/7452806
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The 2(-4(chloro phenyl-1H- benzo[d]imidazol)-1-yl)phenyl)methanone (CBIPM) was synthesized and tested as a corrosion inhibitor for mild steel in 1.0 M HCl solution using electrochemical and spectroscopy measurements. Results obtained showed that this compound has a good inhibition properties for mild steel corrosion in acidic medium which its inhibition efficiency value reaches 98.9 % at 10-3 M. So, the potentiodynamic polarization curves showed that the CBIPM has a mixed type inhibitor. In addition, it is shown that the obtained results were confirmed by the UV-vis spectroscopic measurements. It is found that the inhibitor forms a complex with Fe2+ ion. On the other hand, the experimental results were completed by quantum chemical calculations using DFT method at the B3LYP/6-31G* level of theory. It is found that the theoretical and experimental results are in good agreement.
本研究合成并表征了2-[4-(氯苯基)-1H-苯并[d]咪唑-1-基]苯基甲酮(CBIPM),将其作为缓蚀剂应用于1.0 M盐酸溶液中的碳钢腐蚀防护,并采用电化学与光谱测试手段开展性能评估。实验结果表明,该化合物对酸性介质中的碳钢腐蚀具有优异的缓蚀性能,在浓度为10⁻³ M时,其缓蚀效率可达98.9%。动电位极化曲线测试结果显示,CBIPM属于混合型缓蚀剂。此外,紫外-可见(UV-vis)光谱测试验证了上述实验结论,研究发现该缓蚀剂可与Fe²+离子形成配合物。另一方面,本研究采用密度泛函理论(DFT)方法,在B3LYP/6-31G*基组水平上开展量子化学计算,对实验结果进行补充完善。结果表明,理论计算与实验结果具有良好的一致性。
创建时间:
2018-12-01



