Pcb-126

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Properties Simple | Detailed

Formula C12H5Cl5
IUPAC Name 1,2,3-trichloro-5-(3,4-dichlorophenyl)benzene
Molecular Mass 326.433 g·mol−1
Heat of Formation 23.9 ± 16.7 kJ·mol−1
Dipole Moment 1.59 ± 1.08 D
Volume 310.79 Å 3
Surface Area 284.56 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
Synonyms
  • 1,1'-biphenyl, 3,3',4,4',5-pentachloro-
  • 3,3',4,4',5-pcb
  • 3,3',4,4',5-pentachloro-1,1'-biphenyl
  • 3,3',4,4',5-pentachlorobiphenyl
  • 3,4,3',4',5'-pentachlorobiphenyl
  • 3,4,5,3',4'-penta coplanar polychlorinated biphenyl
  • 3,4,5,3',4'-pentachloro-biphenyl
  • 3,4,5,3',4'-pentachlorobiphenyl
  • pcb 126
  • pcb 126- 3,3',4,4',5-pentachlorobiphenyl
  • pcb 126/pcb 153; binary mixture
  • pcb 126/pcb118
CAS Number(s)
  • 57465-28-8
InChIKey REHONNLQRWTIFF-UHFFFAOYSA-N
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Elements H C Cl