3-Nitroso-7,8,9,10-Tetrahydrobenzo[Pqr]Tetraphene

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Properties Simple | Detailed

Formula C20H15NO
IUPAC Name 3-nitroso-7,8,9,10-tetrahydrobenzo[a]pyrene
Molecular Mass 285.339 g·mol−1
Heat of Formation 268.9 ± 16.7 kJ·mol−1
Dipole Moment 4.99 ± 1.08 D
Volume 329.27 Å 3
Surface Area 291.76 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -1.64 ± eV
Point Group Symmetry C1
Synonyms
  • 3-nitroso-7,8,9,10-tetrahydrobenzo(a)pyrene
  • benzo(a)pyrene, 7,8,9,10-tetrahydro-3-nitroso-
CAS Number(s)
  • 134998-76-8
InChIKey BQARVUKCXRAJKO-UHFFFAOYSA-N
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