Login / Signup

Preorganization and Cooperation for Highly Efficient and Reversible Capture of Low-Concentration CO2 by Ionic Liquids.

Yanjie HuangGuokai CuiYuling ZhaoHuiyong WangZhiyong LiSheng DaiHuiyong Wang
Published in: Angewandte Chemie (International ed. in English) (2017)
A novel strategy based on the concept of preorganization and cooperation has been designed for a superior capacity to capture low-concentration CO2 by imide-based ionic liquids. By using this strategy, for the first time, an extremely high gravimetric CO2 capacity of up to 22 wt % (1.65 mol mol-1 ) and excellent reversibility (16 cycles) have been achieved from 10 vol. % of CO2 in N2 when using an ionic liquid having a preorganized anion. Through a combination of quantum-chemical calculations and spectroscopic investigations, it is suggested that cooperative interactions between CO2 and multiple active sites in the preorganized anion are the driving force for the superior CO2 capacity and excellent reversibility.
Keyphrases
  • ionic liquid
  • highly efficient
  • room temperature
  • molecular dynamics
  • single molecule
  • molecular dynamics simulations
  • monte carlo