Relative electrophilicity and aromaticity
作者： Siamak Noorizadeh , Ehsan Shakerzadeh
DOI: 10.1016/J.CPLETT.2009.11.035
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摘要: Abstract Using the isomerization method, Isomerization Stabilization Energies (ISEs) are computed for some five-membered heterocyclic rings, penta- and hepta-fulvene compounds. quadratic model (Δ ω Q ), Janak’s approximation J ) recently introduced Morse-Like function approach M relative electrophilicities evaluated these systems. An excellent linear correlation between latter aromaticity measures observed also orders of aromaticities successfully predicted using Minimum Electrophilicity Principle (MEP). Therefore, it is claimed that prediction in different systems, obtained values from more reliable than those which calculated approximate models.
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