(17β)-3-Hydroxyestra-1,3,5(10)-Trien-17-Yl Hydrogen Sulfate

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Formula C18H24O5S
IUPAC Name [(8s,9s,13s,14r,17r)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] hydrogen sulfate
Molecular Mass 352.445 g·mol−1
Heat of Formation -945.0 ± 16.7 kJ·mol−1
Dipole Moment 2.05 ± 1.08 D
Volume 403.07 Å 3
Surface Area 333.42 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
InChIKey JSUDNGPWAXYETN-ILOCAZANSA-N
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