(2S,4Ar,6R,7R,7As)-6-[6-Amino-8-[[Amino(Pentyl)Amino]Methyl]Purine-1,3,7-Triium-9-Yl]-2-Hydroxy-2-Oxo-4A,6,7,7A-Tetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-7-Ol
Properties
| Property | Value |
|---|---|
| Formula | C16H26N7O6P |
| IUPAC Name | (2s,4ar,6r,7r,7as)-6-[6-amino-8-[[amino(pentyl)amino]methyl]purine-1,3,7-triium-9-yl]-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol |
| Molecular Mass | 443.395 g·mol−1 |
| Heat of Formation | -1033.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.83 ± 1.08 D |
| Volume | 487.95 Å 3 |
| Surface Area | 414.4 Å 2 |
| HOMO Energy | -9.19 ± 0.55 eV |
| LUMO Energy | -0.78 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PFTHSVVKFAIHAF-RVXWVPLUSA-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 |