15-Hydroxypregn-4-Ene-3,20-Dione

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Formula C21H30O3
IUPAC Name (8r,9s,10r,13s,14r,15r,17s)-17-acetyl-15-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Molecular Mass 330.461 g·mol−1
Heat of Formation -691.0 ± 16.7 kJ·mol−1
Dipole Moment 8.11 ± 1.08 D
Volume 416.14 Å 3
Surface Area 327.56 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy 0.06 ± eV
Point Group Symmetry C1
InChIKey LEWIUXKKQXGQRR-LTGKAUERSA-N
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Elements H C O