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- W2084591887 abstract "Abstract Molar Kerr constants and electric dipole moments of hydrogen bonded complexes that pyridine-N-oxide and its derivatives form with phenols are studied (a) experimentally, (b) by the vector/tensor addition scheme, and (c) by AM1 and PM3 semi-empirical quantum chemical methods. The data are used to establish the geometry of the complexes. It is shown that for a series of pyridine-N-oxide derivatives, the logarithm of the complex formation equilibrium constant correlates with the charge on the oxygen atom of the N–O group. A method to calculate the first and second complex formation constants based on the electric properties of the individual components of the complex is proposed. A relationship between the polarity of the hydrogen bond and the sum of the charges on the hydrogen and oxygen atoms forming the bond is established for the complexes under study." @default.
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- W2084591887 date "1999-11-01" @default.
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- W2084591887 title "Structure and properties of hydrogen bonded complexes of pyridine-N-oxide and its derivatives" @default.
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- W2084591887 doi "https://doi.org/10.1016/s0022-2860(99)00036-8" @default.
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