(1R,4R,5R)-3-(3-Benzoylphenyl)-1,4,5-Trihydroxy-2-Cyclohexene-1-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C20H18O6 |
| IUPAC Name | (1r,4r,5r)-3-(3-benzoylphenyl)-1,4,5-trihydroxy-cyclohex-2-ene-1-carboxylic acid |
| Molecular Mass | 354.353 g·mol−1 |
| Heat of Formation | -838.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.80 ± 1.08 D |
| Volume | 403.13 Å 3 |
| Surface Area | 353.2 Å 2 |
| HOMO Energy | -10.17 ± 0.55 eV |
| LUMO Energy | 2.04 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XHOCFTKQBAZROZ-POAQFYNOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |