3-[(E)-2-(2-{6-[(E)-2-(3,4-Dihydroxyphenyl)Vinyl]-4-Hydroxy-2-Oxo-2H-Pyran-3-Yl}-4,5-Dihydroxyphenyl)Vinyl]-8,9-Dihydroxy-1H,6H-Pyrano[4,3-C]Isochromene-1,6-Dione
Properties
| Property | Value |
|---|---|
| Formula | C33H20O13 |
| IUPAC Name | 4-[6-[2-(3,4-dioxocyclohexa-1,5-dien-1-yl)ethynyl]-2,4-dioxo-pyran-3,6-diid-3-yl]-6-oxo-3-[(e)-2-(1,6,8,9-tetraoxo-4h-pyrano[4,3-c]isochromene-3,4,4a,10b-tetraid-3-yl)vinyl]hex-5-en-1-yn-1-olate |
| Molecular Mass | 624.504 g·mol−1 |
| Heat of Formation | -1603.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.24 ± 1.08 D |
| Volume | 656.18 Å 3 |
| Surface Area | 567.73 Å 2 |
| HOMO Energy | -8.64 ± 0.55 eV |
| LUMO Energy | 1.40 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZNLSHKJBXWCRKW-CLLRDSTBSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |