(8R,9S,10R,13S,14S,17R)-13-Ethyl-17-Ethynyl-2,3,6,7,8,9,10,11,12,13,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Ol

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Formula C21H30O
IUPAC Name (8r,9s,10r,13r,14s,17r)-13-ethyl-17-ethynyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-17-ol
Molecular Mass 298.462 g·mol−1
Heat of Formation -104.6 ± 16.7 kJ·mol−1
Dipole Moment 1.22 ± 1.08 D
Volume 398.38 Å 3
Surface Area 320.79 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 1.23 ± eV
Point Group Symmetry C1
InChIKey MXXKGWYLIJQEBP-VXAANUECSA-N
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