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Theoretical insights into the reaction mechanisms between 2,3,7,8-tetrachlorodibenzofuran and the methylidyne radical
To explore the potential role of the methylidyne radical (CH) in the transformation of 2,3,7,8-tetrachlorodibenzofuran (TCDF), in this study, the detailed reaction mechanisms between TCDF and CH radical have been systematically investigated employing the B3LYP method of density functional theory (DF...
Autores principales: | Wei, Wenjing, Wang, Weihua, Xu, Kaining, Feng, Wenling, Li, Xiaoping, Li, Ping |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9080895/ https://www.ncbi.nlm.nih.gov/pubmed/35539902 http://dx.doi.org/10.1039/c8ra03046d |
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