[(2R,3S,4R,5R)-3,4-Dihydroxy-5-(2-Oxo-6-Thioxo-3H-Purin-7-Ium-4-Id-9-Yl)Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C10H14N4O8PS |
| IUPAC Name | [(2r,3s,4r,5r)-3,4-dihydroxy-5-(2-oxo-6-thioxo-3h-purin-7-ium-4-id-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 381.279 g·mol−1 |
| Heat of Formation | -1475.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.65 ± 1.08 D |
| Volume | 377.1 Å 3 |
| Surface Area | 329.21 Å 2 |
| HOMO Energy | -8.58 ± 0.55 eV |
| LUMO Energy | -1.41 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PHAMIWMCTDMBBS-UUOKFMHZSA-Q |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |