• Title of article

    On the structure of m-benzynes

  • Author/Authors

    B.Andes Hess Jr.، نويسنده , , B، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2002
  • Pages
    4
  • From page
    75
  • To page
    78
  • Abstract
    The question of the structure of m-benzynes is discussed in light of recent theoretical and experimental results. The calculated density functional IR spectrum (B3LYP) of tetrafluoro-m-benzyne is reported and compared with the experiment. It is concluded that without additional experiments and possibly calculations the question of whether m-benzynes exist as a closed shell bicyclic or open shell monocyclic structures cannot yet be definitely answered.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2002
  • Journal title
    Chemical Physics Letters
  • Record number

    1779312