2-Nitrooxanthrene

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Properties Simple | Detailed

Formula C12H7NO4
IUPAC Name 2-nitrodibenzo-p-dioxin
Molecular Mass 229.188 g·mol−1
Heat of Formation -73.2 ± 16.7 kJ·mol−1
Dipole Moment 5.86 ± 1.08 D
Volume 239.36 Å 3
Surface Area 230.44 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 1.55 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-nitro-dibenzo-p-dioxin
  • 2-nitrodibenzo-4-dioxin
  • dibenzo-p-dioxin, 2-nitro-
  • nitrodibenzo-p-dioxin
CAS Number(s)
  • 38178-41-5
InChIKey PBIXRFKWYPNCAB-UHFFFAOYSA-N
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