Benzo[Pqr]Tetraphene-3,6-Dione

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Properties Simple | Detailed

Formula C20H10O2
IUPAC Name benzo[a]pyrene-3,6-dione
Molecular Mass 282.292 g·mol−1
Heat of Formation 70.5 ± 16.7 kJ·mol−1
Dipole Moment 5.46 ± 1.08 D
Volume 309.39 Å 3
Surface Area 275.83 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy 0.82 ± eV
Point Group Symmetry Cs
Synonyms
  • 3,6-benzo(a)pyrenedione
  • 3,6-benzo(a)pyrenequinone
  • benzo(a)pyrene 3,6-dione
  • benzo(a)pyrene-3,6-dione
  • benzo(a)pyrene-3,6-dione, radical ion(1-)
  • benzo(a)pyrene-3,6-quinone
  • benzo[b]pyrene-3,6-quinone
  • bp-3,6-quinone
CAS Number(s)
  • 3067-14-9
  • 64133-78-4
InChIKey MYRYNZSMCVOJHZ-UHFFFAOYSA-N
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