Density functional theory study of mechanism of forming a spiro-Si-heterocyclic ring compound from Me2SiSi: and acetaldehyde

Density functional theory study of mechanism of forming a spiro-Si-heterocyclic ring compound from Me2SiSi: and acetaldehyde

The H2SiSi: and its derivatives (X2SiSi:, X = H, Me, F, Cl, Br, Ph, Ar…) is a new species. Its cycloaddition reaction is a new area for the study of silylene chemistry. The mechanism of the cycloaddition reaction between singlet Me2SiSi: and acetaldehyde has been investigated with the B3LYP/6-31G...

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Bibliographic Details
Main Authors: Xiuhui Lu, Leyi Shi, Jingjing Ming
Format: Article
Language:English
Published: Elsevier 2016-01-01
Series:Arabian Journal of Chemistry
Subjects:
Me2SiSi
Four-membered Si-heterocyclic ring silylene
Spiro-Si-heterocyclic ring compound
Potential energy profile
Online Access:http://www.sciencedirect.com/science/article/pii/S1878535215000350

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