Mechanism of fixation of CO2 with an epoxide catalyzed by ZnBr2 and a choline chloride co-catalyst: a DFT study

Author:

Huang Tengfei12345,Fang Lei12345,Li Ya12345,He Hongqing678910,Wang Li12345,Zhang Jinglai12345

Affiliation:

1. Institute of Environmental and Analytical Sciences

2. College of Chemistry and Chemical Engineering

3. Henan University

4. Kaifeng

5. P. R. China

6. Wuhan Center for Magnetic Resonance

7. State Key Laboratory of Magnetic Resonance and Atomic and Molecular Physics

8. Wuhan Institute of Physics and Mathematics

9. Chinese Academy of Sciences

10. Wuhan 430071

Abstract

The cycloaddition mechanism of the reaction of propylene oxide with CO2 catalyzed by ZnBr2/choline chloride is elucidated using a DFT method.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Reference44 articles.

1. Salen-Complex-Mediated Formation of Cyclic Carbonates by Cycloaddition of CO2 to Epoxides

2. Insights into quaternary ammonium salts-catalyzed fixation carbon dioxide with epoxides

3. Synthesis of cyclic carbonates from epoxides and CO2

4. United Nations Development Programme , United Nations Department of Economic, Social Affairs, and World Energy Council, World Energy Assessment: Energy and the Challenge of Sustainability, United Nations Development Programme, New York, 2000

5. Chemical Fixation of Carbon Dioxide by NaI/PPh3/PhOH

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