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首页> 外文期刊>International Journal of Electrochemical Science >Voltammetric and Quantum Investigation of Selected Succinimides
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Voltammetric and Quantum Investigation of Selected Succinimides

机译:所选琥珀酰亚胺的伏安和量子研究

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A series of succinimide derivatives were studied using the cyclic and square wave voltammetry.Density function theory was used in order to determinate which of the structural parameters influencethe electrochemical activity. The quantum chemical calculations of the investigated succinimides werelinked with the experimental electrochemical data and used to propose the oxidation mechanism. Themost active among studied succinimides is 1,3-diphenylsuccinimide. The results obtained from thecyclic and square wave voltammetry and quantum chemical calculations indicate that the investigatedcompounds undergo oxidation by irreversible, diffusion controlled process including transfer of 1e–and 1 proton. The voltammetric and DFT results signify that the mechanism of electrochemicaloxidation of all compounds involve the conversion of carbonyl-methyne-phenyl segment or methylenegroup in free radical. This conversion proceeds by the loss of one proton one electron process.
机译:使用循环伏安法和方波伏安法研究了一系列琥珀酰亚胺衍生物。使用密度函数理论来确定哪些结构参数影响电化学活性。将所研究的琥珀酰亚胺的量子化学计算与实验电化学数据联系起来,并提出了氧化机理。在所研究的琥珀酰亚胺中,最活跃的是1,3-二苯基琥珀酰亚胺。从循环和方波伏安法以及量子化学计算获得的结果表明,所研究的化合物通过不可逆的,受扩散控制的过程经历了氧化,包括1e–和1质子的转移。伏安法和DFT结果表明,所有化合物的电化学氧化机理都涉及羰基-亚甲基-苯基链段或亚甲基在自由基中的转化。这种转化通过失去一个质子一个电子过程而进行。

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