Title of article :
An electrostatic scale of substituent resonance effect
Author/Authors :
Sayyed، نويسنده , , Fareed Bhasha and Suresh، نويسنده , , Cherumuttathu H. Suresh، نويسنده ,
Issue Information :
هفته نامه با شماره پیاپی سال 2009
Pages :
4
From page :
7351
To page :
7354
Abstract :
Substituent resonance constant, σ R v is calculated from substituted benzenes using molecular electrostatic potential (MESP). The reliability of σ R v is rigorously verified using isodesmic reactions and found that the energy component of substituent resonance effect is proportional to σ R v . Thus the MESP approach enabled the definition to an electrostatic scale of substituent resonance effect.
Keywords :
Resonance effect , Molecular electrostatic potential , Isodesmic reactions , substituent effects , Density functional theory
Journal title :
Tetrahedron Letters
Serial Year :
2009
Journal title :
Tetrahedron Letters
Record number :
1867279
Link To Document :
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