[(1S)-1-[(6-Aminopurine-1,3,7-Triium-9-Yl)Methyl]-2-Hydroxy-Ethoxy]Methylphosphonic Acid
Properties
| Property | Value |
|---|---|
| Formula | C9H14N5O5P |
| IUPAC Name | [(1s)-1-[(6-aminopurine-1,3,7-triium-9-yl)methyl]-2-hydroxy-ethoxy]methylphosphonic acid |
| Molecular Mass | 303.212 g·mol−1 |
| Heat of Formation | -916.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.80 ± 1.08 D |
| Volume | 324.8 Å 3 |
| Surface Area | 273.92 Å 2 |
| HOMO Energy | -9.05 ± 0.55 eV |
| LUMO Energy | -0.83 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BUUUEODHGWQDDY-LURJTMIESA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |