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Strong structure sensitivity in the partial oxidation of styrene on silver single crystals

机译:在单晶中苯乙烯部分氧化中具有很强的结构敏感性

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In contrast to the formation of styrene oxide on Ag(111), phenylacetaldehyde and phenylketene dominate the partial oxidation of styrene on Ag(110), even though the reactions follow the same mechanism on both surfaces. The origin of this difference is that on Ag(1 10) the activation energy for transformation of the oxametallacycle to the combustion intermediate is much lower than on the (111) surface, so that ring-closure of the oxametallacycle to form styrene oxide is short circuited. Also the combustion intermediate appears more stable on Ag(110) than on Ag(111).
机译:与在Ag(111)上形成苯乙烯氧化物相反,尽管乙二醛在两个表面上遵循相同的机理,但苯乙醛和苯乙烯酮主导了在Ag(110)上苯乙烯的部分氧化。这种差异的根源在于,在Ag(1 10)上,用于将氧杂金属环化合物转化为燃烧中间体的活化能远低于(111)表面上的活化能,因此氧杂金属环化合物形成苯乙烯氧化物的闭环很短。电路。同样,燃烧中间体在Ag(110)上比在Ag(111)上看起来更稳定。

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