(1S,4S,8R,9R,12S,13S,16R)-9-Hydroxy-7,7-Dimethyl-17-Methylene-3,10-Dioxapentacyclo[14.2.1.0~1,13~.0~4,12~.0~8,12~]Nonadecane-2,18-Dione
Properties
| Property | Value |
|---|---|
| Formula | C20H26O5 |
| IUPAC Name | (1s,4s,8r,9r,12s,13s,16r)-9-hydroxy-7,7-dimethyl-17-methylene-3,10-dioxapentacyclo[14.2.1.0 1,13 .0 4,12 .0 8,12 ]nonadecane-2,18-dione |
| Molecular Mass | 346.417 g·mol−1 |
| Heat of Formation | -862.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.34 ± 1.08 D |
| Volume | 405.26 Å 3 |
| Surface Area | 312.53 Å 2 |
| HOMO Energy | -10.05 ± 0.55 eV |
| LUMO Energy | -0.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QOAOBBJDPFYUKJ-RVMSTXCCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |