2021•Organic Chemistry FrontiersRequires access

Lithium–bromine exchange reaction on C 60 : first theoretical proposal of a stable singlet fullerene carbene without the heteroatom

Mengyang Li, Yaoxiao Zhao, Kun Yuan, Yanbo Han, Jie Zhang, Yong Wu, Masahiro Ehara, Shigeru Nagase, Xiang Zhao

Abstract

A stable singlet fullerene carbene without heteroatom is firstly proposed, and two indexes are firstly suggested to estimate the occurrence of carbene insertion or addition. The interaction between LiBr and carbon atom in LiBr -compounds is explored.

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Available abstract

Key concepts: Carbene, Heteroatom, Chemistry, Fullerene, Bromine, Singlet state, Lithium (medication), Singlet oxygen