(3α,20S)-Pregn-4-Ene-3,20-Diol

Molecule SVG Image

Properties Simple | Detailed

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
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O