Xestoquinone

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Properties Simple | Detailed

Formula C20H14O4
IUPAC Name xestoquinone
Molecular Mass 318.323 g·mol−1
Heat of Formation -276.2 ± 16.7 kJ·mol−1
Dipole Moment 4.91 ± 1.08 D
Volume 350.41 Å 3
Surface Area 303.34 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy -1.96 ± eV
Point Group Symmetry C1
Synonyms
  • 1-xqn
  • 1h-benzo(6,7)phenanthro(10,1-bc)furan-6,8,11(12bh)-trione, 2,3-dihydro-12b-methyl-, (s)-
CAS Number(s)
  • 97743-96-9
InChIKey HDONDRKCXFRHQQ-FQEVSTJZSA-N
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