4,5-Didehydro-5,6-Dihydro-β,β-Carotene-3,3'-Diol
Properties
| Property | Value |
|---|---|
| Formula | C40H56O2 |
| IUPAC Name | (1r)-4-[(1e,3e,5e,7e,9e,11e,13e,15e,17e)-18-[(1r,4r)-4-hydroxy-2,6,6-trimethyl-cyclohex-2-en-1-yl]-3,7,12,16-tetramethyl-octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethyl-cyclohex-3-en-1-ol |
| Molecular Mass | 568.871 g·mol−1 |
| Heat of Formation | -198.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.98 ± 1.08 D |
| Volume | 805.6 Å 3 |
| Surface Area | 678.63 Å 2 |
| HOMO Energy | -7.92 ± 0.55 eV |
| LUMO Energy | -0.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KBPHJBAIARWVSC-IBIXTYKJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |