[(2R,3S,4R,5R)-5-(6-Amino-8H-Purin-9-Ium-8-Ylium-9-Yl)-4-(4-Ethyl-2-Aza-1-Azonia-3-Azanidacyclopenta-1,4-Dien-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C14H19N8O6P |
| IUPAC Name | [(2r,3s,4r,5r)-5-(6-amino-8h-purin-9-ium-8-ylium-9-yl)-4-(4-ethyl-2-aza-1-azonia-3-azanidacyclopenta-1,4-dien-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 426.324 g·mol−1 |
| Heat of Formation | -884.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.29 ± 1.08 D |
| Volume | 449.49 Å 3 |
| Surface Area | 388.11 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | -0.76 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SDJJYRFRALNBFM-IDTAVKCVSA-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 |