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Structure-Property Correlation:XVI.~1 Linear Molecules

机译:结构-性能相关性:XVI。〜1线性分子

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摘要

The structure-property correlation for linear molecules of the A_n type is represented by a simple function of n with a restricted number of parameters.The correlation is similar for all linear molecules with similar variations of all contributing values,so that related properties of any linear molecules vary similarly.This was exemplified by various physicochemical properties (boiling point,melting point,heat of sublimation,heat of vaporization,diamagnetic susceptibility,ionization potential,long-wave transition energy,hyperpo-larizability,logarithm of the octanol-water distribution coefficient) for all saturated linear hydrocarbons and corresponding perfluoro derivatives,unsaturated linear hydrocarbons and those with conjugated double bonds,oligothiophenes,linearly fused aromatic rings,RNA duplexes,and bilayer lipide membranes.The simplified relations obtained allow a sufficiently precise assessment of various properties of any linear molecule.
机译:A_n型线性分子的结构性质相关性由参数有限的n的简单函数表示。所有线性分子的相关性都相似,所有贡献值的变化都相似,因此任何线性分子的变化类似)适用于所有饱和直链烃及其相应的全氟衍生物,不饱和直链烃以及具有共轭双键,低聚噻吩,线性稠合芳环,RNA双链体和双层脂质膜的直链烃。获得的简化关系可对任何分子的各种性质进行足够精确的评估线性分子。

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