Roads to pentazolate anion: a theoretical insight

Roads to pentazolate anion: a theoretical insight

The formation mechanism of pentazolate anion (PZA) is not yet clear. In order to present the possible formation pathways of PZA, the potential energy surfaces of phenylpentazole (PPZ), phenylpentazole radical (PPZ-R), phenylpentazole radical anion (PPZ-RA), PPZ and m-chloroperbenzoic acid (m-CPBA),...

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Bibliographic Details
Main Authors: Tao Yu, Yi-Ding Ma, Wei-Peng Lai, Ying-Zhe Liu, Zhong-Xue Ge, Gan Ren
Format: Article
Language:English
Published: The Royal Society 2018-01-01
Series:Royal Society Open Science
Subjects:
potential energy surface
reaction mechanism
polynitrogen
pentazole
Online Access:https://royalsocietypublishing.org/doi/pdf/10.1098/rsos.172269

Internet

https://royalsocietypublishing.org/doi/pdf/10.1098/rsos.172269

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