(22E)-Cholesta-1,4,22-Trien-3-One

Molecule SVG Image

Properties Simple | Detailed

Formula C27H40O
IUPAC Name (8s,9s,10r,13r,14s,17r)-17-[(e,1r)-1,5-dimethylhex-2-enyl]-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Molecular Mass 380.606 g·mol−1
Heat of Formation -278.7 ± 16.7 kJ·mol−1
Dipole Moment 5.94 ± 1.08 D
Volume 521.66 Å 3
Surface Area 417.05 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
InChIKey AJWONNNXQUONDT-UAJHHUEASA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O