(1R,2R,3S,3Ar,8Bs)-1-Acetoxy-8B-Hydroxy-6,8-Dimethoxy-3A-(4-Methoxyphenyl)-3-Phenyl-2,3,3A,8B-Tetrahydro-1H-Benzo[B]Cyclopenta[D]Furan-2-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C29H28O9 |
| IUPAC Name | carbon dioxide; (3s)-3-(1-ethynylprop-2-ynyl)-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-8-(oxomethylene)-3,4,5,9-tetrahydrocyclopenta[b]oxocine-6,7-dione |
| Molecular Mass | 520.527 g·mol−1 |
| Heat of Formation | -1319.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.75 ± 1.08 D |
| Volume | 598.63 Å 3 |
| Surface Area | 457.41 Å 2 |
| HOMO Energy | -8.67 ± 0.55 eV |
| LUMO Energy | 3.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XGFHSPORRWHGPC-IDAMAFBJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |