(3S,4Ar,6Ar,12As,12Bs)-4A,8,12B-Trihydroxy-3-Methyl-3,4,6A,12A-Tetrahydro-2H-Benzo[A]Xanthene-1,12-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C18H18O6
IUPAC Name (3s,4ar,6ar,12as,12bs)-4a,8,12b-trihydroxy-3-methyl-3,4,6a,12a-tetrahydro-2h-benzo[a]xanthene-1,12-dione
Molecular Mass 330.332 g·mol−1
Heat of Formation -894.8 ± 16.7 kJ·mol−1
Dipole Moment 4.45 ± 1.08 D
Volume 363.19 Å 3
Surface Area 304.74 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy 2.11 ± eV
Point Group Symmetry C1
InChIKey DPKVWUQVXHLZHB-XUBRCTPKSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O