Title of article :
A study on the aromaticity of [n]phenacenes and [n]helicenes (n = 3–9)
Author/Authors :
Kalam، نويسنده , , Horigul and Kerim، نويسنده , , Ablikim and Najmidin، نويسنده , , Kalbinur and Abdurishit، نويسنده , , Paruza and Tawar، نويسنده , , Tursungul، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2014
Pages :
6
From page :
320
To page :
325
Abstract :
We studied the global and local aromaticity of [n]phenacenes and [n]helicenes for n = 3–9 using the topological resonance energy and the magnetic resonance energy methods. The local aromaticity of the individual rings was studied using the bond resonance energy, the circuit resonance energy, and the ring current methods. Our results were compared with the results obtained by others who used the para-delocalization index, the harmonic oscillator model of aromaticity, and the nucleus-independent chemical shift indices. We found that sextet rings in the Clar structure are the main source of aromatic stabilization.
Journal title :
Chemical Physics Letters
Serial Year :
2014
Journal title :
Chemical Physics Letters
Record number :
1936162
Link To Document :
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