(3α,8Xi,9Xi,14Xi)-3-Hydroxy-3-Methylpregnan-20-One
Properties
Property | Value |
---|---|
Formula | C22H36O2 |
IUPAC Name | 1-[(3r,5s,8r,9s,10s,13s,14r,17s)-3-hydroxy-3,10,13-trimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]ethanone |
Molecular Mass | 332.520 g·mol−1 |
Heat of Formation | -655.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.94 ± 1.08 D |
Volume | 442.3 Å 3 |
Surface Area | 343.89 Å 2 |
HOMO Energy | -9.85 ± 0.55 eV |
LUMO Energy | 1.07 ± eV |
Point Group Symmetry | C1 |
InChIKey | PGTVWKLGGCQMBR-VCRFCNJVSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |