کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
5271898 1385451 2013 4 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Parr's index to describe both electrophilicity and nucleophilicity
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی آلی
پیش نمایش صفحه اول مقاله
Parr's index to describe both electrophilicity and nucleophilicity
چکیده انگلیسی

We have disclosed a new aspect of Parr's ω value (ω = μ2/2η), which was originally proposed as an electrophilicity index, and reformed the ω value as a useful single scale from electrophilicity to nucleophilicity by introducing the corresponding ε values (ε = μη). The plot of the ω values against the ε values (ω-ε correlation) presented a fine parabola for 65 chemical species: the order of the electrophilicity is seen at negative ε values and the order of nucleophilicity is seen at positive ε values.

Parr's ω values of 65 chemical species were plotted as a function of the newly introduced ε values, ω = (η/2)ε2 + με. The fine parabola indicates the order of nucleophilicity at positive ε values and the order of electrophilicity at negative ε values.

ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Tetrahedron Letters - Volume 54, Issue 4, 23 January 2013, Pages 339-342
نویسندگان
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