期刊
CHEMICAL COMMUNICATIONS
卷 57, 期 25, 页码 3115-3118出版社
ROYAL SOC CHEMISTRY
DOI: 10.1039/d0cc07894h
关键词
-
资金
- National Natural Science Foundation of China [21873052]
- Natural Science Foundation of Zhejiang Province [LQ20B030004]
DFT calculations reveal that the iodine of cobalt(ii)-iodylarene complexes acts as a directing group via halogen bonding interaction to substrates. A transient 3c-4e bond is formed during oxidation reactions to decrease the activation energy by electron delocalization. Dehydrogenation of dihydroantharacene proceeds via a novel concerted hydride transfer/proton transfer mechanism.
DFT calculations reveal that the iodine of cobalt(ii)-iodylarene complexes acts as a directing group via halogen bonding interaction to substrates. A transient 3c-4e bond is formed during oxidation reactions to decrease the activation energy by electron delocalization. Dehydrogenation of dihydroantharacene proceeds via a novel concerted hydride transfer/proton transfer mechanism.
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