1,2,3,4,7,8-Hexachlorooxanthrene

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Properties Simple | Detailed

Formula C12H2Cl6O2
IUPAC Name 1,2,3,4,7,8-hexachlorodibenzo-p-dioxin
Molecular Mass 390.861 g·mol−1
Heat of Formation -218.8 ± 16.7 kJ·mol−1
Dipole Moment 0.11 ± 1.08 D
Volume 340.92 Å 3
Surface Area 303.88 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C2v
Synonyms
  • 1,2,3,4,7,8-hcdd
  • 1,2,3,4,7,8-hexachloro-dibenzo[b,e][1,4]dioxin
  • 1,2,3,4,7,8-hexachlorodibenzo(b,e)(1,4)dioxin
  • 1,2,3,4,7,8-hexachlorodibenzo-p-dioxin [dioxin and dioxin-like compounds]
  • 1,2,3,4,7,8-hexachlorodibenzodioxin
  • d 66
  • dibenzo(b,e)(1,4)dioxin, 1,2,3,4,7,8-hexachloro-
  • dibenzo-p-dioxin, 1,2,3,4,7,8-hexachloro-
  • dibenzo-p-dioxin, hexachloro-
  • hexachlorodibenzo-p-dioxin
CAS Number(s)
  • 39227-28-6
InChIKey WCYYQNSQJHPVMG-UHFFFAOYSA-N
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Elements H C O Cl