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Mechanistic Studies on the Dibenzofuran Formation from Phenanthrene, Fluorene and 9–Fluorenone

We carried out molecular orbital theory calculations for the homogeneous gas‑phase formation of dibenzofuran from phenanthrene, fluorene, 9-methylfluorene and 9-fluorenone. Dibenzofuran will be formed if ∙OH adds to C(8a), and the order of reactivity follows as 9-fluorenone > 9-methylfluorene >...

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Detalles Bibliográficos
Autores principales: Li, Shanqing, Zhang, Qingzhu
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4394475/
https://www.ncbi.nlm.nih.gov/pubmed/25756381
http://dx.doi.org/10.3390/ijms16035271