2-Amino-9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-7-Methyl-8-Thioxo-3H-Purine-1,7,9-Triium-6-One
Properties
| Property | Value |
|---|---|
| Formula | C11H20N5O5S+ |
| IUPAC Name | 2-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7-methyl-8-thioxo-3h-purine-1,7,9-triium-6-one |
| Molecular Mass | 334.372 g·mol−1 |
| Heat of Formation | -644.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.17 ± 1.08 D |
| Volume | 343.4 Å 3 |
| Surface Area | 292.06 Å 2 |
| HOMO Energy | -8.22 ± 0.55 eV |
| LUMO Energy | -0.48 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RVXYLIZYSBBHNY-HNBCOOGTSA-P |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |