Atrovirisidone

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Properties Simple | Detailed

Formula C24H26O7
IUPAC Name 2,7,9-trihydroxy-1-methoxy-3,4-bis(3-methylbut-2-enyl)benzo[b][1,4]benzodioxepin-6-one
Molecular Mass 426.459 g·mol−1
Heat of Formation -1020.8 ± 16.7 kJ·mol−1
Dipole Moment 2.90 ± 1.08 D
Volume 498.03 Å 3
Surface Area 412.11 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -0.76 ± eV
Point Group Symmetry C1
Synonyms
  • 2,7,9-trihydroxy-1-methoxy-3,4-bis(3-methylbut-2-enyl)-6-benzo[b][1,4]benzodioxepinone
InChIKey KGIATYCAIYWYED-UHFFFAOYSA-N
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Elements H C O