DFT Study of the Reaction Mechanisms of Carbon Dioxide and its Isoelectronic Molecules CS2 and OCS Dissolved in Pyrrolidinium and Imidazolium Acetate Ionic Liquids

2016 ◽  
Vol 120 (23) ◽  
pp. 5243-5254 ◽  
Author(s):  
Y. Danten ◽  
M. I. Cabaço ◽  
J. A. P. Coutinho ◽  
Noël Pinaud ◽  
M. Besnard
Keyword(s):  
Carbon Dioxide ◽  
Ionic Liquids ◽  
Reaction Mechanisms ◽  
Dft Study ◽  
Isoelectronic Molecules

Reaction mechanisms of carbon dioxide, ethylene oxide and amines catalyzed by ionic liquids BmimBr and BmimOAc: a DFT study

2016 ◽  
Vol 18 (40) ◽  
pp. 27951-27957 ◽  
Author(s):  
Zhoujie Luo ◽  
Binsen Wang ◽  
Yuan Liu ◽  
Guohua Gao ◽  
Fei Xia
Keyword(s):  
Carbon Dioxide ◽  
Hydrogen Bond ◽  
Ionic Liquids ◽  
Ethylene Oxide ◽  
Reaction Mechanisms ◽  
Catalytic Conversion ◽  
Dft Study

The binary ionic liquids BmimBr and BmimOAc have the important electrostatic and hydrogen bond effects on the catalytic conversion of carbon dioxide, ethylene oxide and aniline to 3-phenyl-2-oxazolidionone.

Synthesis of Urea Derivatives using Carbon Dioxide as Carbonylation Reagent in Ionic Liquids

2017 ◽  
Vol 4 (2) ◽  
Author(s):  
Xing He ◽  
Xiao-Ya Li ◽  
Yu Song ◽  
Shu-Mei Xia ◽  
Xian-Dong Lang ◽  
...  
Keyword(s):  
Carbon Dioxide ◽  
Ionic Liquids ◽  
Urea Derivatives

DFT Study on the Chemical Absorption Mechanism of CO2 in Diamino Protic Ionic Liquids

2021 ◽  
Vol 125 (5) ◽  
pp. 1416-1428
Author(s):  
Jing Ma ◽  
Yutong Wang ◽  
Xueqing Yang ◽  
Mingxuan Zhu ◽  
Baohe Wang
Keyword(s):  
Ionic Liquids ◽  
Dft Study ◽  
Protic Ionic Liquids ◽  
Absorption Mechanism ◽  
Chemical Absorption

Effect of the Side-Chain Length and NLO Properties of the N-ethyl-N,N,N-trialkylammonium Ionic Liquids – A DFT Study

2021 ◽  
pp. 116251
Author(s):  
M.A. Olea-Amezcua ◽  
J.E. Castellanos-Águila ◽  
H. HernÁndez-Cocoletzi ◽  
E. Ferreira ◽  
M. Trejo-Durán ◽  
...  
Keyword(s):  
Ionic Liquids ◽  
Chain Length ◽  
Dft Study ◽  
Side Chain ◽  
Side Chain Length ◽  
Nlo Properties

scholarly journals Carbon dioxide capture using water-imidazolium ionic liquids-amines ternary systems

2021 ◽  
Vol 105 ◽  
pp. 103210
Author(s):  
Mariusz Zalewski ◽  
Tomasz Krawczyk ◽  
Agnieszka Siewniak ◽  
Aleksander Sobolewski
Keyword(s):  
Carbon Dioxide ◽  
Ionic Liquids ◽  
Carbon Dioxide Capture ◽  
Ternary Systems ◽  
Imidazolium Ionic Liquids

One-Pot Conversion of Carbon Dioxide, Ethylene Oxide, and Amines to 3-Aryl-2-oxazolidinones Catalyzed with Binary Ionic Liquids

ChemCatChem ◽  
2013 ◽  
Vol 6 (1) ◽  
pp. 278-283 ◽  
Author(s):  
Binshen Wang ◽  
Elnazeer H. M. Elageed ◽  
Dawei Zhang ◽  
Sijuan Yang ◽  
Shi Wu ◽  
...  
Keyword(s):  
Carbon Dioxide ◽  
Ionic Liquids ◽  
Ethylene Oxide ◽  
One Pot

Ionic liquids and supercritical carbon dioxide: green and alternative reaction media for chemical processes

2016 ◽  
Vol 32 (6) ◽  
Author(s):  
Ruixia Liu ◽  
Peng Zhang ◽  
Suojiang Zhang ◽  
Ting Yan ◽  
Jiayu Xin ◽  
...  
Keyword(s):  
Carbon Dioxide ◽  
Ionic Liquids ◽  
Supercritical Carbon Dioxide ◽  
Chemical Processes ◽  
Reaction Media ◽  
Supercritical Carbon

AbstractIonic liquids (ILs) and supercritical CO

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