Synthesis in combination with Biological and Computational evaluations of selenium-N-Heterocyclic Carbene compounds

Computational and Theoretical Chemistry(2021)

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摘要
•Organoselenium compounds and their salts were designed, theoretically studied, and synthesized.•Theoretical and experimental results were compared.•Antioxidant property evaluation revealed L1 has more significant free radical scavenging property.
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关键词
N-Heterocyclic carbenes,Selenones,DFT,Bis-imidazolium salt,Se-NHC,Biological activity
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