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5. DFT Study on the Formation Mechanism of Normal and Abnormal N-Heterocyclic Carbene-Carbon Dioxide Ad

DFT Study on the Formation Mechanism of Normal and Abnormal N-Heterocyclic Carbene-Carbon Dioxide Ad

来源 :第十三届全国量子化学会议 | 被引量 : 0次 | 上传用户：bright_wish

【摘 要】

：

　　To illustrate the formation mechanism of normal and abnormal N-heterocyclic carbene-carbon dioxide adducts(NHC-CO2 and aNHC-CO2),we implement DFT calculatio

【作 者】

：

Mengmeng Dong Chenbu Liu Dongju Zhang 

【机 构】

：

Institute of Theoretical Chemistry,Shandong University,Jinan,250100

【出 处】

：

第十三届全国量子化学会议

【发表日期】

：

2017年期

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　　To illustrate the formation mechanism of normal and abnormal N-heterocyclic carbene-carbon dioxide adducts(NHC-CO2 and aNHC-CO2),we implement DFT calculations on the reactions of imidazolium-based ionic liquids with CO2.

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