Insight into the Mechanism of Glycerol Dehydration and Subsequent Pyridine Synthesis

In the present study, glycerol was exploited as the feedstock to synthesize pyridine with ammonia gas as a carrier and reactant through thermal conversion. A density functional theory (DFT) at the M06-2X method was applied to understand the mechanism of glycerol dehydration, the ammonization of oxyg...

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Veröffentlicht in:	ACS sustainable chemistry & engineering 2021-03, Vol.9 (8), p.3095-3103
Hauptverfasser:	Jiang, Ding, Wang, Shuang, Li, Hongping, Xu, Lujiang, Hu, Xun, Barati, Bahram, Zheng, Anqing
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
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