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Tuning the strength of cation coordination interactions of dual functional ionic liquids for improving CO2 capture performance

机译:调整双官能离子液体阳离子协调相互作用改善CO2捕获性能的强度

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摘要

A novel strategy for efficient CO2 capture by tuning the strength of cation coordination interactions of alkali metal chelated dual functional ionic liquids (DFILs) is reported. CO2 absorption and viscosity experiment, quantum-mechanical calculations showed that the strengthening of the coordination interactions between alkali metal ions and alkanolamine ligands of DFILs containing imidazolide anion ([Im](-)) leads to improve the stability of the cheated cation and weaken the chelated cation-anion interaction, resulting in efficient CO2 capture capacity and reducing the viscosity of DFILs. Particularly, [K(DGA)(2)][Im] has the stronger cation coordination interactions and lower viscosity (249.8 mPa.s), exhibiting more efficient CO2 capture capacity than other DFILs, with an extremely high capacity of CO2 (similar to 1.37 mol/mol) in 15 min at T = 333.2 K under atmospheric pressure and good reversibility (5 recycles). Spectroscopic investigations and quantum-mechanical calculations showed that such high CO2 capacity originates from the fact that both [K(DGA)(2)](+) and [Im](-) of [K(DGA)(2)][Im] react with CO2. Moreover, [Im](-) reacts preferentially with CO2 over [K(DGA)(2)](+).
机译:据报道,通过调节碱金属螯合的双官能离子液(DFILs)的阳离子配位相互作用的高效CO2捕获的新策略。 CO 2吸收和粘度实验,量子力学计算表明,加强碱金属离子和含有咪唑胺阴离子([IM]( - ))的DFIL的链烷醇胺配体之间的配位相互作用导致欺骗阳离子的稳定性,削弱了螯合阳离子阴离子相互作用,导致有效的CO2捕获能力和降低DFIL的粘度。特别地,[K(DGA)(2)] [IM]具有较强的阳离子配位相互作用和较低粘度(249.8MPa.S),表现出比其他DFIL更高的CO 2捕获能力,具有极高的CO2容量(类似于1.37mol / mol)在大气压下在T = 333.2 k下在15分钟内,良好的可逆性(5回收)。光谱研究和量子 - 机械计算表明,这种高CO 2的能力来自[K(DGA)(2)] [IM] [k(DGA)(2)](+)和[IM]( - )和[IM]( - )[IM ]与CO2反应。此外,[IM]( - )优选地用CO 2反应[K(DGA)(2)](+)。

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