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Thermal Conversion of Methane to Formaldehyde Promoted by Gold in AuNbO3+ Cluster Cations

机译:AuNbO3 +簇阳离子中金促进的甲烷热转化为甲醛

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摘要

In addition to generation of a methyl radical, formation of a formaldehyde molecule was observed in the thermal reaction of methane with AuNbO3+ heteronuclear oxide cluster cations. The clusters were prepared by laser ablation and mass-selected to react with CH4 in an ion-trap reactor under thermal collision conditions. The reaction was studied by mass spectrometry and DFT calculations. The latter indicated that the gold atom promotes formaldehyde formation through transformation of an Au-O bond into an Au-Nb bond during the reaction.
机译:除了产生甲基自由基外,在甲烷与AuNbO3 +异核氧化物簇阳离子的热反应中还观察到甲醛分子的形成。通过激光烧蚀制备团簇,并在热碰撞条件下在离子阱反应器中选择质量使其与CH4反应。通过质谱和DFT计算研究了该反应。后者表明金原子通过在反应过程中将Au-O键转变为Au-Nb键来促进甲醛形成。

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