Cilinaphthalide B

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Properties Simple | Detailed

Formula C23H22O7
IUPAC Name 9-(3,4-dimethoxyphenyl)-4,6,7-trimethoxy-3h-benzo[f]isobenzofuran-1-one
Molecular Mass 410.417 g·mol−1
Heat of Formation -806.1 ± 16.7 kJ·mol−1
Dipole Moment 5.31 ± 1.08 D
Volume 470.37 Å 3
Surface Area 400.62 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry C1
Synonyms
  • 9-(3,4-dimethoxyphenyl)-4,6,7-trimethoxy-3h-benzo[f][2]benzoxol-1-one
  • 9-(3,4-dimethoxyphenyl)-4,6,7-trimethoxy-3h-benzo[f]isobenzofuran-1-one
InChIKey GQAJQAMRZKZXNJ-UHFFFAOYSA-N
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