Estrone

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Formula C18H22O2
IUPAC Name (8s,9s,13s,14r)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-one
Molecular Mass 270.366 g·mol−1
Heat of Formation -387.5 ± 16.7 kJ·mol−1
Dipole Moment 4.17 ± 1.08 D
Volume 334.47 Å 3
Surface Area 273.14 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy 0.15 ± eV
Point Group Symmetry C1
InChIKey DNXHEGUUPJUMQT-HPFXQQBRSA-N
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Elements H C O