(1R,2R,9S,11R)-11-Hydroxy-2-Methoxy-9,11-Dimethyl-10-Methylene-3-Oxatricyclo[7.3.1.0~2,6~]Tridec-5-En-4-One
Properties
| Property | Value |
|---|---|
| Formula | C16H22O4 |
| IUPAC Name | (1r,2r,9s,11r)-11-hydroxy-2-methoxy-9,11-dimethyl-10-methylene-3-oxatricyclo[7.3.1.0 2,6 ]tridec-5-en-4-one |
| Molecular Mass | 278.343 g·mol−1 |
| Heat of Formation | -665.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.85 ± 1.08 D |
| Volume | 339.01 Å 3 |
| Surface Area | 273.1 Å 2 |
| HOMO Energy | -9.91 ± 0.55 eV |
| LUMO Energy | -0.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SQWYVTVFJMUPOS-BVUBDWEXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |