(2R,4As,6R,7R,7Ar)-2-Hydroxy-6-[6-[[(1R)-1-Methyl-2-Phenyl-Ethyl]Amino]Purine-1,3,7-Triium-9-Yl]-2-Oxo-4A,6,7,7A-Tetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-7-Ol
Properties
| Property | Value |
|---|---|
| Formula | C19H24N5O6P |
| IUPAC Name | (2r,4as,6r,7r,7ar)-2-hydroxy-6-[6-[[(1r)-1-methyl-2-phenyl-ethyl]amino]purine-1,3,7-triium-9-yl]-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol |
| Molecular Mass | 449.397 g·mol−1 |
| Heat of Formation | -963.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.32 ± 1.08 D |
| Volume | 489.38 Å 3 |
| Surface Area | 414.6 Å 2 |
| HOMO Energy | -8.77 ± 0.55 eV |
| LUMO Energy | -0.39 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QQKKXVULNZUEAU-OCXLHJLWSA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |