1-(β-D-Glucopyranosyl)-5-Methyl-2,4(1H,3H)-Pyrimidinedione
Properties
| Property | Value |
|---|---|
| Formula | C11H16N2O7 |
| IUPAC Name | 5-methyl-1-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]pyrimidin-1-ium-5-ide-2,4-dione |
| Molecular Mass | 288.254 g·mol−1 |
| Heat of Formation | -1248.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.16 ± 1.08 D |
| Volume | 315.9 Å 3 |
| Surface Area | 278.4 Å 2 |
| HOMO Energy | -9.51 ± 0.55 eV |
| LUMO Energy | -0.47 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RMXUFBPORJBBEZ-HPFNVAMJSA-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 |