5-Fluoro-1-[3-C-(Hydroxymethyl)-β-D-Glucopyranosyl]-2,4(1H,3H)-Pyrimidinedione

Molecule SVG Image

Properties Simple | Detailed

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
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F