2-Fluoro-9-[5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)-D-Arabinofuranosyl]-9H-Purin-6-Amine

Molecule SVG Image

Properties Simple | Detailed

Formula C10H15FN5O13P3
IUPAC Name [[(2r,3s,4r,5r)-5-(6-amino-2-fluoro-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
Molecular Mass 525.171 g·mol−1
Heat of Formation -3222.3 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 493.2 Å 3
Surface Area 392.07 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -1.41 ± eV
Point Group Symmetry C1
InChIKey PIOKUWLZUXUBCO-ICKFSKTQSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N P