(3S,3Ar,4Ar,5S,6R,7Ar,9As)-5,6-Dihydroxy-3,5,8-Trimethyl-3A,4,4A,5,6,7,7A,9A-Octahydroazuleno[6,5-B]Furan-2(3H)-One
Properties
| Property | Value |
|---|---|
| Formula | C15H22O4 |
| IUPAC Name | (1s,3ar,5as,7r,8s,8ar,9ar)-7,8-dihydroxy-1,5,8-trimethyl-1,3a,5a,6,7,8a,9,9a-octahydroazuleno[6,5-b]furan-2-one |
| Molecular Mass | 266.333 g·mol−1 |
| Heat of Formation | -801.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.46 ± 1.08 D |
| Volume | 328.33 Å 3 |
| Surface Area | 274.72 Å 2 |
| HOMO Energy | -9.74 ± 0.55 eV |
| LUMO Energy | 0.69 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XXFLOPBDRWUQBW-LXAYBOCESA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |