1,3,6,8-Tetrachlorooxanthrene

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Properties Simple | Detailed

Formula C12H4Cl4O2
IUPAC Name 1,3,6,8-tetrachlorodibenzo-p-dioxin
Molecular Mass 321.971 g·mol−1
Heat of Formation -180.8 ± 16.7 kJ·mol−1
Dipole Moment 0.00 ± 1.08 D
Volume 300.84 Å 3
Surface Area 277.16 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy 1.77 ± eV
Point Group Symmetry C2h
Synonyms
  • 1,3,6,8-tcdd
  • 1,3,6,8-tetrachlorodibenzo-para-dioxin
  • 1,3,6,8-tetrachlorodibenzo[b,e][1,4]dioxin
  • 1,3,6,8-tetrachlorodibenzodioxin
  • 1,3,6,8-tetrachlorodibenzodioxine
  • dibenzo(b,e)(1,4)dioxin, 1,3,6,8-tetrachloro-
  • dibenzo-p-dioxin, 1,3,6,8-tetrachloro-
CAS Number(s)
  • 33423-92-6
InChIKey OTQFXRBLGNEOGH-UHFFFAOYSA-N
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Elements H C O Cl