2-Amino-9-[(2S,3Ar,4R,6R,6Ar)-2-Hydroxy-6-(Hydroxymethyl)-2-Sulfidotetrahydrofuro[3,4-D][1,3,2]Dioxaphosphol-4-Yl]-3,9-Dihydro-6H-Purin-6-One
Properties
| Property | Value |
|---|---|
| Formula | C10H12N5O6PS |
| IUPAC Name | 9-[(2r,3ar,4r,6r,6ar)-2-hydroxy-6-(hydroxymethyl)-2-sulfido-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ium-4-yl]-2-amino-3h-purine-1,7-diium-4-id-6-one |
| Molecular Mass | 361.271 g·mol−1 |
| Heat of Formation | -1013.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 10.27 ± 1.08 D |
| Volume | 358.09 Å 3 |
| Surface Area | 311.63 Å 2 |
| HOMO Energy | -9.19 ± 0.55 eV |
| LUMO Energy | -1.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QZEROIIFJLCOOE-KVBUDSETSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |