[(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl [(2S,4S)-4-Hydroxy-2,4-Dioxo-1,3,5,2Λ5,4Λ5-Trioxadiphosphinan-2-Yl] Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C11H18N5O14P3+ |
| IUPAC Name | [(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2s,4s)-4-hydroxy-2,4-dioxo-1,3,5,2λ5,4λ5-trioxadiphosphinan-2-yl] hydrogen phosphate |
| Molecular Mass | 537.207 g·mol−1 |
| Heat of Formation | -3093.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 13.42 ± 1.08 D |
| Volume | 485.09 Å 3 |
| Surface Area | 393.41 Å 2 |
| HOMO Energy | -9.33 ± 0.55 eV |
| LUMO Energy | -1.67 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FUGVEMPWYITROY-GMJOMIMCSA-P |
| 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 |