(17β)-3,17-Dihydroxyestra-1,3,5(10),9(11)-Tetraen-12-One

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Properties Simple | Detailed

Formula C18H20O3
IUPAC Name (8s,13s,14r,17r)-3,17-dihydroxy-13-methyl-7,8,14,15,16,17-hexahydro-6h-cyclopenta[a]phenanthren-12-one
Molecular Mass 284.350 g·mol−1
Heat of Formation -488.7 ± 16.7 kJ·mol−1
Dipole Moment 7.41 ± 1.08 D
Volume 339.34 Å 3
Surface Area 287.42 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 3.14 ± eV
Point Group Symmetry C1
InChIKey UFZJCFGLLBQULK-IIVZCXTMSA-N
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