[[(2R,3S,5R)-5-(2-Amino-4-Oxo-1,5-Dihydropyrrolo[2,3-D]Pyrimidine-3,7-Diium-5-Id-7-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C11H18N4O13P3+ |
IUPAC Name | [[(2r,3s,5r)-5-(2-amino-4-oxo-1,5-dihydropyrrolo[2,3-d]pyrimidine-3,7-diium-5-id-7-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
Molecular Mass | 507.201 g·mol−1 |
Heat of Formation | -3088.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.11 ± 1.08 D |
Volume | 479.43 Å 3 |
Surface Area | 390.96 Å 2 |
HOMO Energy | -8.90 ± 0.55 eV |
LUMO Energy | 1.33 ± eV |
Point Group Symmetry | C1 |
InChIKey | DWNAUZLVZDLJJN-XLPZGREQSA-P |
QR Code | Generate QR Code |
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Elements | P C H O N |