(5Z,7Z)-9,10-Secopregna-5,7,10-Triene-1,3-Diol

Molecule SVG Image

Properties Simple | Detailed

Formula C21H32O2
IUPAC Name (1s,3r,5z)-5-[(2z)-2-[(1r,3ar,7ar)-1-ethyl-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol
Molecular Mass 316.478 g·mol−1
Heat of Formation -445.7 ± 16.7 kJ·mol−1
Dipole Moment 3.58 ± 1.08 D
Volume 430.74 Å 3
Surface Area 351.15 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
InChIKey XMDLIEZJERQGEY-MYTBFJFNSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O