8'-O-Demethylnigerone

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Properties Simple | Detailed

Formula C31H24O10
IUPAC Name 5,8-dihydroxy-10-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxo-benzo[g]chromen-10-yl)-6-methoxy-2-methyl-benzo[g]chromen-4-one
Molecular Mass 556.516 g·mol−1
Heat of Formation -1348.5 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 599.37 Å 3
Surface Area 486.52 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 2.12 ± eV
Point Group Symmetry C1
InChIKey HSDNSZPETUJPJT-UHFFFAOYSA-N
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