Theoretical perspective on the reaction mechanism from arylpentazenes to arylpentazoles: new insights into the enhancement of cyclo-N5 production.

作者: Guanghua Ren , Runze Liu , Panwang Zhou , Chaoyang Zhang , Jianyong Liu

DOI: 10.1039/C8CC10024A

关键词:

摘要: A thorough theoretical exploration of the formation mechanism of arylpentazole (cyclo-N5), the key precursor of cyclo-N5−, has been performed. Three arylpentazene conformers were …

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