[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl [(2R,3R,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-4-Fluoro-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C19H23FN7O11P++ |
IUPAC Name | [(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2r,3r,4r,5r)-5-(2,4-dioxo-5h-pyrimidin-1-ium-5-id-1-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-yl] hydrogen phosphate |
Molecular Mass | 575.398 g·mol−1 |
Heat of Formation | -2159.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.98 ± 1.08 D |
Volume | 582.05 Å 3 |
Surface Area | 408.65 Å 2 |
HOMO Energy | -9.12 ± 0.55 eV |
LUMO Energy | -0.74 ± eV |
Point Group Symmetry | C1 |
InChIKey | ORHPEFQOHSRVPY-YRHMQFFASA-Q |
QR Code | Generate QR Code |
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Elements | C F H O N P |