21-Hydroxypregna-1,4-Diene-3,11,20-Trione
Properties
Property | Value |
---|---|
Formula | C21H26O4 |
IUPAC Name | (8s,9s,10s,13r,14s,17s)-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,12,14,15,16,17-octahydro-6h-cyclopenta[a]phenanthrene-3,11-dione |
Molecular Mass | 342.429 g·mol−1 |
Heat of Formation | -628.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.28 ± 1.08 D |
Volume | 420.57 Å 3 |
Surface Area | 334.27 Å 2 |
HOMO Energy | -9.86 ± 0.55 eV |
LUMO Energy | -0.49 ± eV |
Point Group Symmetry | C1 |
InChIKey | HPXOYVSJRIINKV-FWWKOUSWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |