(3Z,17α)-3-(Methoxyimino)-19-Norpregn-4-En-20-Yn-17-Ol

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Formula C21H29NO2
IUPAC Name (3z,8r,9s,10r,13s,14s,17r)-17-ethynyl-3-methoxyimino-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
Molecular Mass 327.460 g·mol−1
Heat of Formation -63.0 ± 16.7 kJ·mol−1
Dipole Moment 2.39 ± 1.08 D
Volume 421.04 Å 3
Surface Area 350.93 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy 0.32 ± eV
Point Group Symmetry C1
InChIKey LCSBNAMHSCHNAR-UGCMNZCRSA-N
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