3-Ethynylperylene

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Properties Simple | Detailed

Formula C22H12
IUPAC Name 3-ethynylperylene
Molecular Mass 276.331 g·mol−1
Heat of Formation 579.6 ± 16.7 kJ·mol−1
Dipole Moment 0.65 ± 1.08 D
Volume 325.87 Å 3
Surface Area 290.31 Å 2
HOMO Energy -8.11 ± 0.55 eV
LUMO Energy -1.50 ± eV
Point Group Symmetry Cs
Synonyms
  • perylene, 3-ethynyl-
CAS Number(s)
  • 132196-66-8
InChIKey VOVKFLKDPQAQIR-UHFFFAOYSA-N
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Elements H C