(9Xi,17Xi)-6,9-Difluoro-11-Hydroxy-16-Methyl-3-Oxo-20-Thioxopregna-1,4-Dien-17-Yl Acetate

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Formula C24H30F2O4S
IUPAC Name [(6s,8s,9r,10s,11r,13s,14s,16s,17r)-17-ethanethioyl-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] acetate
Molecular Mass 452.554 g·mol−1
Heat of Formation -1036.7 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 519.95 Å 3
Surface Area 386.2 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -1.56 ± eV
Point Group Symmetry C1
InChIKey SMYZRHBMSHREEP-MXDUHQIDSA-N
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