[5-[6-Amino-2-(3-Aminopropylsulfanyl)Purin-9-Yl]-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C13H22N6O10P2S |
| IUPAC Name | [(2r,3s,4r,5r)-5-[6-amino-2-(3-aminopropylsulfanyl)purin-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydroxyphosphoryl hydrogen phosphate |
| Molecular Mass | 516.361 g·mol−1 |
| Heat of Formation | -2214.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.04 ± 1.08 D |
| Volume | 526.03 Å 3 |
| Surface Area | 396.22 Å 2 |
| HOMO Energy | -8.72 ± 0.55 eV |
| LUMO Energy | -1.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GESRDRIVMAOVGE-WJOUQXRDSA-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 |