Estra-1,3,5(10)-Triene-2,17β-Diol

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Formula C18H24O2
IUPAC Name (8s,9s,13s,14r,17r)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,17-diol
Molecular Mass 272.382 g·mol−1
Heat of Formation -437.8 ± 16.7 kJ·mol−1
Dipole Moment 2.44 ± 1.08 D
Volume 343.03 Å 3
Surface Area 286.92 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 0.16 ± eV
Point Group Symmetry C1
InChIKey YEOSPIFUAAHCPK-TVNOUSRMSA-N
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Elements H C O