Lakbaibi Zouhair, Damej Mohamed, Molhi Abdu, Benmessaoud Mohammed, Tighadouini Said, Jaafar Adil, Benabbouha Tariq, Ansari Abdeselam, Driouich Anas, Tabyaoui Mohamed
Laboratory of Molecular Chemistry, Materials and Environment, Department of Chemistry, Multidisciplinary Faculty, Mohamed first University, BP 300 Selouane 62700, Nador, Morocco.
Environment, Materials and Sustainable Development Team-CERNE2D, High School of Technology, Mohammed V University, Rabat, Morocco.
Heliyon. 2022 Mar 15;8(3):e09087. doi: 10.1016/j.heliyon.2022.e09087. eCollection 2022 Mar.
The exploitation of cost-effective, sustainable, green and efficient compounds is a renewed science and a demanding mission for today's chemists and technologists. In this view, the inhibitive corrosion properties of some hydrazine derivatives named (1,2)-bis(1-(2-nitrophenyl)ethylidene)hydrazine (), (1,2)-bis(1-(3-nitrophenyl)ethylidene)hydrazine () and (1,2)-bis(1-(4-nitrophenyl)ethylidene)hydrazine () on the C38 steel corrosion in 1M HCl media has been evaluated by different techniques like electrochemical impedance spectroscopy (EIS), potentiodynamic polarization (PDP), scanning electron microscopy (SEM) and energy-dispersive X-ray spectroscopy. The EIS results showed that is the greatest inhibitor ( %) among the three tested compounds. The gives considerable inhibition efficiency against corrosion of steel compared to the previous studies. The PDP curves indicated that the studied inhibitors were a mixed-type inhibitor with a predominantly cathodic control. Quantum calculations of some descriptors derived from the density functional theory (DFT), the transition state theory (TST), the quantum theory of atoms in molecules (QTAIM) and molecular dynamics simulation have delivered helpful information regarding electron transfer and mechanism during adsorption of inhibitors on C38 steel surface.
开发具有成本效益、可持续、绿色且高效的化合物是一门新兴科学,也是当今化学家和技术专家面临的一项艰巨任务。从这个角度来看,已通过电化学阻抗谱(EIS)、动电位极化(PDP)、扫描电子显微镜(SEM)和能量色散X射线光谱等不同技术评估了一些肼衍生物,即(1,2)-双(1-(2-硝基苯基)亚乙基)肼()、(1,2)-双(1-(3-硝基苯基)亚乙基)肼()和(1,2)-双(1-(4-硝基苯基)亚乙基)肼()在1M HCl介质中对C38钢腐蚀的缓蚀性能。EIS结果表明,在所测试的三种化合物中,是最强的缓蚀剂( %)。与先前的研究相比,对钢的腐蚀具有相当高的缓蚀效率。PDP曲线表明,所研究的缓蚀剂是一种混合型缓蚀剂,主要起阴极控制作用。从密度泛函理论(DFT)、过渡态理论(TST)、分子中的原子量子理论(QTAIM)和分子动力学模拟得出的一些描述符的量子计算,提供了有关缓蚀剂在C38钢表面吸附过程中的电子转移和机理的有用信息。