Title of article :
Evidence from current-density mapping for σ-delocalisation in the aromatic hexaiodobenzene cation
Author/Authors :
Havenith، نويسنده , , Remco W.A. and Fowler، نويسنده , , Patrick W. and Fias، نويسنده , , Stijn and Bultinck، نويسنده , , Patrick، نويسنده ,
Issue Information :
هفته نامه با شماره پیاپی سال 2008
Abstract :
Calculation of high σ-delocalisation in the iodine periphery of the hexaiodobenzene cation, accompanied by a four-electron through-space σ ring current, provides direct computational evidence for the attribution to this ion of σ-aromaticity co-existing with the conventional π-aromaticity that it shares with its neutral parent.
Keywords :
Aromaticity , ring current , Hexaiodobenzene , ?-Aromaticity , Multi-centre index
Journal title :
Tetrahedron Letters
Journal title :
Tetrahedron Letters