[(2R,3S,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-2-(Phosphonooxymethyl)Tetrahydrofuran-3-Yl] [(2R,3S,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C19H25N7O13P2++ |
IUPAC Name | [(2r,3s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] [(2r,3s,5r)-5-(2,4-dioxo-5h-pyrimidin-1-ium-5-id-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
Molecular Mass | 621.388 g·mol−1 |
Heat of Formation | -2680.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.42 ± 1.08 D |
Volume | 633.65 Å 3 |
Surface Area | 446.07 Å 2 |
HOMO Energy | -9.02 ± 0.55 eV |
LUMO Energy | -0.89 ± eV |
Point Group Symmetry | C1 |
InChIKey | FVKQICOBJKECDT-IDMWBNCISA-Q |
QR Code | Generate QR Code |
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Elements | P C H O N |