DFT Mechanistic Insights into Aldehyde Deformylations with Biomimetic Metal–Dioxygen Complexes: Distinct Mechanisms and Reaction Rules

• Ruihua Zhao,
• Bei-Bei Zhang,
• Zheyuan Liu,
• Gui-Juan Cheng,
• Zhi-Xiang Wang

Affiliations

Ruihua Zhao

School of Chemical Sciences, University of Chinese Academy of Sciences, Beijing, China

Bei-Bei Zhang

School of Chemical Sciences, University of Chinese Academy of Sciences, Beijing, China

Zheyuan Liu

College of Materials Science and Engineering, Fuzhou University, Fuzhou, China

Gui-Juan Cheng

Warshel Institute for Computational Biology, School of Life and Health Sciences, The Chinese University of Hong Kong (Shenzhen), Shenzhen, China

Zhi-Xiang Wang

School of Chemical Sciences, University of Chinese Academy of Sciences, Beijing, China