Browsing by Subject "2,2-dimethyl-3-butenal"

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The mechanism of the gas-phase elimination kinetics of the β,γ-unsaturated aldehyde 2,2–dimethyl-3-butenal: a theoretical study

Rodriguez, Andrea; Cartaya, Loriett; Maldonado, Alexis; Marquez Brazon, Edgar Alexander; Mora, Jose R.; Córdova, Tania C.; Chuchani, Gabriel (Molecular Physics, 2017-03-15)

The study on the mechanism of the gas-phase elimination or thermal decomposition kinetics of 2, 2-dimethyl-3-butenal has been carried out by using theoretical calculation at MP2, combined ab initio CBSQB3 and DFT (B3LYP, ...