(8Xi,9Xi,14Xi,17α)-2-Methoxyestra-1(10),2,4-Triene-3,17-Diol

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Formula C19H23D3O3
IUPAC Name 13-methyl-2-(trideuterio(113c)methoxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Molecular Mass 306.419 g·mol−1
Heat of Formation -577.4 ± 16.7 kJ·mol−1
Dipole Moment 1.05 ± 1.08 D
Volume 373.05 Å 3
Surface Area 313.04 Å 2
HOMO Energy -8.31 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
InChIKey CQOQDQWUFQDJMK-KPFFETTNSA-N
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