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• W3184865315 startingPage "11466" @default.
• W3184865315 abstract "Reactions of MH2 (M = Sr, Ba) with CO2 were explored in pure parahydrogen at 3.5 K using matrix isolation infrared spectroscopy and quantum chemical calculations. The formate complex HM(η2-O2CH) and formic acid complex (MH2)(HCOOH) were trapped and identified by isotopic substitutions and density functional theory (DFT) frequency calculations. Natural population analysis and the CO2 reduction mechanism demonstrate that hydride ion transfer from a metal hydride to a CO2 moiety facilitates the stabilization of such complexes." @default.
• W3184865315 created "2021-08-02" @default.
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• W3184865315 date "2021-07-22" @default.
• W3184865315 modified "2023-09-27" @default.
• W3184865315 title "Activation of CO₂ by Alkaline-Earth Metal Hydrides: Matrix Infrared Spectra and DFT Calculations of HM(O₂CH) and (MH₂)(HCOOH) Complexes (M = Sr, Ba)" @default.
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• W3184865315 doi "https://doi.org/10.1021/acs.inorgchem.1c01477" @default.
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