• Title of article

    The aromaticity of substituted diazanaphthalenes

  • Author/Authors

    Gümü?، نويسنده , , Selçuk، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2011
  • Pages
    5
  • From page
    263
  • To page
    267
  • Abstract
    Substituted (F, Cl, OH) diazanaphthalene derivatives have been considered theoretically to obtain information about their stabilities and aromaticities. The expected decrease of aromaticity of naphthalene itself by double aza substitution has been compensated by substitution of one of the hydrogens of the system by an electronegative atom. The position of the substituent has been proved to be strongly effective on the aromaticity of the structure such that, the aromaticity is enhanced when the susbtituent is closer to the aza points.
  • Keywords
    Aromaticity , NICS , HOMA , Diazanaphthalenes
  • Journal title
    Computational and Theoretical Chemistry
  • Serial Year
    2011
  • Journal title
    Computational and Theoretical Chemistry
  • Record number

    2284701