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首页> 外文期刊>Chemical Physics Letters >Photochemistry of the glyoxal-hydrogen peroxide complexes in solid argon: Formation of 2-hydroxy-2-hydroperoxyethanal
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Photochemistry of the glyoxal-hydrogen peroxide complexes in solid argon: Formation of 2-hydroxy-2-hydroperoxyethanal

机译:固体氩中乙二醛-过氧化氢络合物的光化学:2-羟基-2-氢过氧化乙醛的形成

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摘要

The structure and photochemistry of the glyoxal-hydrogen peroxide complexes isolated in solid argon was studied by help of FTIR spectroscopy and quantum chemistry methods. The comparison of the experimental spectra with the MP2/6-311++G(2d,2p) calculated ones indicates that glyoxal-hydrogen peroxide complexes trapped in the matrix have cyclic structures; each subunit acts as a proton donor and a proton acceptor. Exposure of the complexes to the lambda > 345 nm radiation induces the addition reaction of hydrogen peroxide to glyoxal and formation of the 2-hydroxy-2-hydroperoxyethanal molecule.
机译:借助红外光谱和量子化学方法研究了固体氩中乙二醛-过氧化氢配合物的结构和光化学。将实验光谱与MP2 / 6-311 ++ G(2d,2p)计算得到的光谱进行比较,表明捕获在基质中的乙二醛-过氧化氢配合物具有环状结构。每个亚基都充当质子供体和质子受体。络合物暴露于λ> 345 nm的辐射下会引起过氧化氢与乙二醛的加成反应,并形成2-羟基-2-氢过氧化乙烷分子。

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