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Theoretical study of the carbonyl-ene reaction between formaldehyde and propylene on the MgY zeolite

โœ Scribed by Hui Fu; Shouwen Xie; Aiping Fu; Tianxu Ye

Book ID
116380073
Publisher
Elsevier
Year
2012
Tongue
English
Weight
576 KB
Volume
982
Category
Article
ISSN
2210-271X

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## Abstract The mechanism of the cycloaddition reaction of singlet stannylene and ethylene or formaldehyde has been studied by using density functional theory. The geometrical parameters, harmonic vibrational frequencies and energies of stationary points for potential energy surface are calculated