(3R,3Ar,4Ar,7Ar,8R,9Ar)-3,4A,8-Trimethyl-2,5-Dioxo-2,3,3A,4,4A,5,7A,8,9,9A-Decahydroazuleno[6,5-B]Furan-4-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C17H22O5 |
IUPAC Name | [(1r,3as,5r,5as,8ar,9r,9ar)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1h-azuleno[6,5-b]furan-9-yl] acetate |
Molecular Mass | 306.354 g·mol−1 |
Heat of Formation | -908.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.08 ± 1.08 D |
Volume | 368.53 Å 3 |
Surface Area | 296.45 Å 2 |
HOMO Energy | -10.22 ± 0.55 eV |
LUMO Energy | 2.47 ± eV |
Point Group Symmetry | C1 |
InChIKey | NEIIKBWBBCJSQU-XKRFYNIESA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |