(9Xi,17Xi)-6,9-Difluoro-11-Hydroxy-16-Methyl-3-Oxo-20-Thioxopregna-1,4-Dien-17-Yl Acetate
Properties
Property | Value |
---|---|
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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O F |