(3α,5α,17α)-Estrane-3,17-Diol

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Formula C18H30O2
IUPAC Name (3r,5s,8r,9r,10s,13s,14s,17r)-13-methyl-1,2,3,4,5,6,7,8,9,10,11,12,14,15,16,17-hexadecahydrocyclopenta[a]phenanthrene-3,17-diol
Molecular Mass 278.430 g·mol−1
Heat of Formation -606.3 ± 16.7 kJ·mol−1
Dipole Moment 3.50 ± 1.08 D
Volume 362.92 Å 3
Surface Area 296.54 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 2.98 ± eV
Point Group Symmetry C1
InChIKey QNKATSBSLLYTMH-DMKQDBSESA-N
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Elements H C O