[Hydroxy-[[(2R,3S,5R)-3-Hydroxy-5-(4-Oxo-1,5-Dihydropyrrolo[2,3-D]Pyrimidine-3,7-Diium-5-Id-7-Yl)Tetrahydrofuran-2-Yl]Methoxy]Phosphoryl] Phosphono Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C11H17N3O13P3+ |
IUPAC Name | [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-(4-oxo-1,5-dihydropyrrolo[2,3-d]pyrimidine-3,7-diium-5-id-7-yl)tetrahydrofuran-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate |
Molecular Mass | 492.186 g·mol−1 |
Heat of Formation | -3064.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.70 ± 1.08 D |
Volume | 466.39 Å 3 |
Surface Area | 379.1 Å 2 |
HOMO Energy | -8.81 ± 0.55 eV |
LUMO Energy | -1.71 ± eV |
Point Group Symmetry | C1 |
InChIKey | TUVLMLCMRLGCDG-DJLDLDEBSA-P |
QR Code | Generate QR Code |
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Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |