[(2R,3S,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3-Hydroxy-Tetrahydrothiophen-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C10H14N5O5PS |
| IUPAC Name | [(2r,3s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3-hydroxy-tetrahydrothiophen-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 347.287 g·mol−1 |
| Heat of Formation | -972.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.76 ± 1.08 D |
| Volume | 355.24 Å 3 |
| Surface Area | 299.0 Å 2 |
| HOMO Energy | -8.72 ± 0.55 eV |
| LUMO Energy | -0.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QKZZXOPNVAJHJI-RRKCRQDMSA-O |
| QR Code | Generate QR Code |
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| Elements | C H O N P S |