1,4,5,7-Tetrahydroxy-2,3-Naphthalenedione

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Properties Simple | Detailed

Formula C10H6O6
IUPAC Name 1,4,5,7-tetrahydroxynaphthalene-2,3-dione
Molecular Mass 222.151 g·mol−1
Heat of Formation -744.1 ± 16.7 kJ·mol−1
Dipole Moment 0.58 ± 1.08 D
Volume 220.72 Å 3
Surface Area 210.86 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -2.89 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4,5,7-tetrahydroxy-2,3-naphthoquinone
  • spinochrome b
  • spinochrome b (an)
CAS Number(s)
  • 604-46-6
InChIKey JHMLTYYMTQKQHH-UHFFFAOYSA-N
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