5-Fluoro-1-[3-C-(Hydroxymethyl)-β-D-Glucopyranosyl]-2,4(1H,3H)-Pyrimidinedione
Properties
Property | Value |
---|---|
Formula | C11H15FN2O8 |
IUPAC Name | 5-fluoro-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-4,6-bis(hydroxymethyl)tetrahydropyran-2-yl]pyrimidine-2,4-dione |
Molecular Mass | 322.244 g·mol−1 |
Heat of Formation | -1588.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.17 ± 1.08 D |
Volume | 331.0 Å 3 |
Surface Area | 282.93 Å 2 |
HOMO Energy | -10.03 ± 0.55 eV |
LUMO Energy | 2.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | ASRLDHHNHXDEKP-RZBPYSQRSA-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 |