(3α,5Beta)-3-Hydroxyestran-17-One

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Formula C18H28O2
IUPAC Name (3r,5r,8r,9r,10s,13s,14s)-3-hydroxy-13-methyl-2,3,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydro-1h-cyclopenta[a]phenanthren-17-one
Molecular Mass 276.414 g·mol−1
Heat of Formation -557.2 ± 16.7 kJ·mol−1
Dipole Moment 2.85 ± 1.08 D
Volume 357.01 Å 3
Surface Area 289.82 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 1.00 ± eV
Point Group Symmetry C1
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InChIKey UOUIARGWRPHDBX-DHMVHTBWSA-N
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