3,4-Dihydroxy-5-{[(2E)-3-(4-Hydroxyphenyl)-2-Propenoyl]Oxy}-1-Cyclohexene-1-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C16H16O7 |
| IUPAC Name | (3r,4s,5r)-3,4-dihydroxy-5-[(e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-cyclohexene-1-carboxylic acid |
| Molecular Mass | 320.294 g·mol−1 |
| Heat of Formation | -1072.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.20 ± 1.08 D |
| Volume | 359.02 Å 3 |
| Surface Area | 334.05 Å 2 |
| HOMO Energy | -9.29 ± 0.55 eV |
| LUMO Energy | -0.99 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GVECSFFLZYNEBO-ADMZAUMBSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |