(9'R)-4',5',9'-Trihydroxy-11'-Oxaspiro[Cyclohexane-1,13'-Tricyclo[7.3.1.0~2,7~]Tridecane]-2,2',4',5,6'-Pentaen-4-One

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Properties Simple | Detailed

Formula C17H16O5
IUPAC Name (1r,9r)-4,5,9-trihydroxyspiro[11-oxatricyclo[7.3.1.02,7]trideca-2,4,6-triene-13,4'-cyclohexa-2,5-diene]-1'-one
Molecular Mass 300.306 g·mol−1
Heat of Formation -633.8 ± 16.7 kJ·mol−1
Dipole Moment 4.31 ± 1.08 D
Volume 332.04 Å 3
Surface Area 279.77 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -0.57 ± eV
Point Group Symmetry C1
InChIKey CZSLURFDEROKDZ-DYVFJYSZSA-N
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