1-Hydro- and 1,10-Dihydro-1,10-phenanthrolinium Perchlorates in Electrocatalytic Production of Molecular Hydrogen

IF 0.8 4区 化学 Q4 CHEMISTRY, ORGANIC Russian Journal of Organic Chemistry Pub Date : 2024-10-14 DOI:10.1134/S1070428024070133
A. D. Yudina, T. V. Boykova, O. Yu. Ganz, L. A. Klimaeva, A. A. Burmistrova, T. O. Karpunina, E. V. Okina
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Abstract

The electrochemical and electrocatalytic properties of 1-hydro-1,10-phenanthrolinium and 1,10-dihydro-1,10-phenanthrolinium perchlorates in formation of molecular hydrogen in the presence of CF3COOH were studied by cyclic voltammetry. The presence of hydrogen atoms at nitrogen atoms in the heterocyclic compounds strongly influences the electrochemical properties of the compounds and the efficiency of the electrocatalytic process. In going from 1-hydro-1,10-phenanthrolinium perchlorate to 1,10-dihydro-1,10-phenanthrolinium perchlorate, the process efficiency increases (TOF and TON values are higher), despite identical mechanisms. The reaction mechanisms were studied by DFT, and the key intermediates were revealed.

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分子氢电催化生产中的 1-氢和 1,10-二氢-1,10-菲罗啉高氯酸盐
通过循环伏安法研究了 1-hydro-1,10-phenanthrolinium 和 1,10-dihydro-1,10-phenanthrolinium 高氯酸盐在 CF3COOH 存在下形成分子氢的电化学和电催化特性。杂环化合物中氮原子上氢原子的存在极大地影响了化合物的电化学特性和电催化过程的效率。从 1-hydro-1,10-phenanthrolinium perchlorate 到 1,10-dihydro-1,10-phenanthrolinium perchlorate,尽管机理相同,但过程效率却提高了(TOF 和 TON 值更高)。通过 DFT 对反应机理进行了研究,并揭示了关键的中间产物。
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来源期刊
CiteScore
1.40
自引率
25.00%
发文量
139
审稿时长
3-6 weeks
期刊介绍: Russian Journal of Organic Chemistry is an international peer reviewed journal that covers all aspects of modern organic chemistry including organic synthesis, theoretical organic chemistry, structure and mechanism, and the application of organometallic compounds in organic synthesis.
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