1,2,3,4,6,7,9-Heptachlorooxanthrene

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Properties Simple | Detailed

Formula C12HCl7O2
IUPAC Name 1,2,3,4,6,7,9-heptachlorodibenzo-p-dioxin
Molecular Mass 425.306 g·mol−1
Heat of Formation -238.3 ± 16.7 kJ·mol−1
Dipole Moment 1.25 ± 1.08 D
Volume 361.1 Å 3
Surface Area 315.64 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -1.63 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,2,3,4,6,7,9-heptachlorodibenzo-para-dioxin
  • 1,2,3,4,6,7,9-heptachlorodibenzodioxin
  • dibenzo(b,e)(1,4)dioxin, 1,2,3,4,6,7,9-heptachloro-
  • dibenzo-p-dioxin, 1,2,3,4,6,7,9-heptachloro-
CAS Number(s)
  • 58200-70-7
InChIKey KTJJIBIRZGQFQZ-UHFFFAOYSA-N
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Elements H C O Cl