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首页> 外文期刊>Journal of Physical Organic Chemistry >Determining the excited-state substituent constants σ_CC~(ex) of meta-substituent from 3,4,-disubstituted stilbenes
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Determining the excited-state substituent constants σ_CC~(ex) of meta-substituent from 3,4,-disubstituted stilbenes

机译:确定3,4,-二取代的斯蒂苯酯的间位取代基的激发态取代基常数σ_CC〜(ex)

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摘要

In this paper, 61 samples of 3,4'-disubstituted stilbenes and 18 samples of 3,3'-disubstituted stilbenes were synthesized, and their UV data were measured in anhydrous ethanol. Based on the UV absorption energy (wavenumber) of 3f4'-disubstituted stilbenes, the excited-state substituent constants of meta-substituent were determined by means of curve-fitting. The availability of σ_(CC)~(ex)(m) was confirmed by the good correlation with the UV absorption energy of 3,4'-disubstituted stilbenes and 4,4'-disubstituted stilbenes. Further, using the obtained constants tr_(CC)(m))~(ex)and the correlation equation, we calculated the UV wavenumbers of 3,3'-disubstituted stilbenes, and the calculated wavenumbers are in good agreement with the experimental values. These results verified that the excited-state substituent constants of meta-substituent are reliable parameter to scale the effect of meta-substituent on the UV absorption energy.
机译:在本文中,合成了61个3,4'-二取代的斯蒂芬苯甲醚样品和18个3,3'-二取代的斯蒂芬苯甲醚样品,并在无水乙醇中测量了它们的紫外线数据。基于3f4′-二取代的对苯二甲酸酯的紫外线吸收能(波数),通过曲线拟合确定了间位取代基的激发态取代基常数。 σ_(CC)〜(ex)(m)的有效性通过与3,4'-双取代的斯蒂芬苯酚和4,4'-双取代的斯蒂芬苯酚的紫外线吸收能良好相关性得到证实。此外,利用获得的常数tr_(CC)(m))〜(ex)和相关方程,我们计算了3,3'-双取代的斯蒂苯的紫外波数,计算出的波数与实验值非常吻合。这些结果证明,间位取代基的激发态取代基常数是衡量间位取代基对紫外线吸收能量影响的可靠参数。

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