期刊
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
卷 133, 期 24, 页码 9274-9277出版社
AMER CHEMICAL SOC
DOI: 10.1021/ja2035514
关键词
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资金
- Division of Chemical Sciences, Geosciences, and Biosciences, Office of Basic Energy Sciences of the U.S. Department of Energy [DE-FG02-84ER13297, DE-SC-0001298]
- Yale University
There is considerable interest in both catalysts for CO2 conversion and understanding how CO2 reacts with transition metal complexes. Here we develop a simple model for predicting the thermodynamic favorability of CO2 insertion into Ir(III) hydrides. In general this reaction is unfavorable; however, we demonstrate that with a hydrogen bond donor in the secondary coordination sphere it is possible to isolate a formate product from this reaction. Furthermore, our CO2 inserted product is one of the most active water-soluble catalysts reported to date for CO2 hydrogenation.
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