Toward a Unified Mechanism for Oxoammonium Salt-Mediated Oxidation Reactions: A Theoretical and Experimental Study Using a Hydride Transfer Model
Toward a Unified Mechanism for Oxoammonium Salt-Mediated Oxidation Reactions: A Theoretical and Experimental Study Using a Hydride Transfer Model
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DOI：
10.1021/acs.joc.5b01240
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发表时间：
2015-08-21
影响因子：
3.6
通讯作者：
Leadbeater, Nicholas E.
中科院分区：
文献类型：
--
作者：
Hamlin, Trevor A.;Kelly, Christopher B.;Leadbeater, Nicholas E.
A range of oxoammonium salt-based oxidation reactions have been explored computationally using density functional theory (DFT), and the results have been correlated with experimentally derived trends in reactivity. Mechanistically, most reactions involve a formal hydride transfer from an activated C-H bond to the oxygen atom of the oxoammonium cation. Several new potential modes of reactivity have been uncovered and validated experimentally.
