Title of article :
Magnetic analysis (NICS) of monoarylic cations. Linear relationship between aromaticity and Hammett constants (σp+)
Author/Authors :
Morao، Ana I. Cavaco نويسنده , , Iٌaki and Hillier، نويسنده , , Ian H، نويسنده ,
Issue Information :
هفته نامه با شماره پیاپی سال 2001
Pages :
3
From page :
4429
To page :
4431
Abstract :
Density Functional Theory (DFT) calculations show that there is a linear correlation between NICS values (aromaticity criterion) and experimental Hammett (Brown) constants (σp+), together with other computed parameters for p-substituted benzyl cations.
Keywords :
DFT calculations , Hammett constants , NICS , Aromaticity
Journal title :
Tetrahedron Letters
Serial Year :
2001
Journal title :
Tetrahedron Letters
Record number :
1645541
Link To Document :
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