5-Fluoro-1-(β-D-Glucopyranosyl)-2,4(1H,3H)-Pyrimidinedione
Properties
Property | Value |
---|---|
Formula | C10H13FN2O7 |
IUPAC Name | 5-fluoro-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 | 292.218 g·mol−1 |
Heat of Formation | -1383.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.79 ± 1.08 D |
Volume | 302.53 Å 3 |
Surface Area | 266.19 Å 2 |
HOMO Energy | -9.97 ± 0.55 eV |
LUMO Energy | -0.93 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
InChIKey | YHWGRVDTEORPPJ-XSEHCYKFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O F |