[[(2R,3S,4S,5R)-5-(4-Aminopyrrolo[2,3-D]Pyrimidine-1,3-Diium-4A-Id-7-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C11H17N4O13P3 |
IUPAC Name | [[(2r,3s,4s,5r)-5-(4-aminopyrrolo[2,3-d]pyrimidine-1,3-diium-4a-id-7-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
Molecular Mass | 506.193 g·mol−1 |
Heat of Formation | -3057.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.39 ± 1.08 D |
Volume | 478.07 Å 3 |
Surface Area | 375.87 Å 2 |
HOMO Energy | -8.75 ± 0.55 eV |
LUMO Energy | -1.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | VEGKFAVLAJCBNS-HGIWHZBTSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |