(9Cis,9'Cis)-5,5',8,8'-Tetrahydro-5,8:5',8'-Diepoxy-β,β-Caroten-3-Ol
Properties
Property | Value |
---|---|
Formula | C40H56O3 |
IUPAC Name | (2s,6s,7as)-2-[(1e,3e,5e,7e,9e,11e,13e)-14-[(2s,7as)-4,4,7a-trimethyl-2,5,6,7-tetrahydrobenzofuran-2-yl]-1,5,10-trimethyl-pentadeca-1,3,5,7,9,11,13-heptaenyl]-4,4,7a-trimethyl-2,5,6,7-tetrahydrobenzofuran-6-ol |
Molecular Mass | 584.871 g·mol−1 |
Heat of Formation | -408.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.21 ± 1.08 D |
Volume | 801.17 Å 3 |
Surface Area | 658.21 Å 2 |
HOMO Energy | -7.93 ± 0.55 eV |
LUMO Energy | -0.70 ± eV |
Point Group Symmetry | C1 |
InChIKey | KCYOZNARADAZIZ-FTTCTRRBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |