Concerted two-proton-coupled electron transfer (2PCET) reaction between catechol and superoxide radical anion
收藏Mendeley Data2024-01-31 更新2024-06-26 收录
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资源简介：
2PCET mechanisms between 1,2-dihydroxybenzene (catechol) and superoxide radical anion (O2•−) in N,N-dimethylformamide. The 2PCET occurs as an intra-complex reaction after the formation of prereactive complex. This reaction was theoretically obtained using the density functional theory (DFT) level with the Becke three-parameter Lee–Yang–Parr functional.
创建时间：
2024-01-31
