1-[(3,4-Dioxo-1,5-Cyclohexadien-1-Yl)(Hydroxy)Methylene]-6,7-Dihydroxy-1,2-Dihydro-3-Isoquinolinecarboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C17H11NO7 |
| IUPAC Name | (1e)-1-[(3,4-dioxocyclohexa-1,5-dien-1-yl)-hydroxy-methylene]-6,7-dihydroxy-2,4,5,8-tetrahydroisoquinoline-3,4,4a,5,6,7,8,8a-octaide-3-carboxylic acid |
| Molecular Mass | 341.272 g·mol−1 |
| Heat of Formation | -773.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.29 ± 1.08 D |
| Volume | 359.72 Å 3 |
| Surface Area | 323.7 Å 2 |
| HOMO Energy | -8.30 ± 0.55 eV |
| LUMO Energy | 2.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QUIWTBSOEFPLHE-FOCLMDBBSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |