21-Hydroxy-3,20-Dioxopregn-4-En-19-Oic Acid
Properties
Property | Value |
---|---|
Formula | C21H28O5 |
IUPAC Name | (8s,9s,10s,13s,14r,17s)-17-(2-hydroxyacetyl)-13-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carboxylic acid |
Molecular Mass | 360.444 g·mol−1 |
Heat of Formation | -963.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.45 ± 1.08 D |
Volume | 432.15 Å 3 |
Surface Area | 342.08 Å 2 |
HOMO Energy | -9.91 ± 0.55 eV |
LUMO Energy | -0.31 ± eV |
Point Group Symmetry | C1 |
InChIKey | RUPOMAOZPOVHQZ-APTISXNFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |