(±)-Thysanone

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Formula C14H12O6
IUPAC Name (1r,3s)-1,7,9-trihydroxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromene-5,10-dione
Molecular Mass 276.241 g·mol−1
Heat of Formation -874.5 ± 16.7 kJ·mol−1
Dipole Moment 3.02 ± 1.08 D
Volume 295.08 Å 3
Surface Area 267.9 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy 1.42 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,3s)-1,7,9-trihydroxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromene-5,10-dione
  • (1r,3s)-1,7,9-trihydroxy-3-methyl-3,4-dihydro-1h-benzo[g]isochromene-5,10-quinone
InChIKey NNXPHSFVRRTOJM-OVZGEXIGSA-N
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