(3α,20S)-Pregn-4-Ene-3,20-Diol
Properties
Property | Value |
---|---|
Formula | C21H34O2 |
IUPAC Name | (3s,8s,9s,10r,13s,14s,17s)-17-[(1r)-1-hydroxyethyl]-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-ol |
Molecular Mass | 318.493 g·mol−1 |
Heat of Formation | -566.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.54 ± 1.08 D |
Volume | 420.26 Å 3 |
Surface Area | 332.55 Å 2 |
HOMO Energy | -9.28 ± 0.55 eV |
LUMO Energy | 4.24 ± eV |
Point Group Symmetry | C1 |
InChIKey | IBMZAHKIAAJREF-NFJVIFTASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |