[(2R,3R,4R,5R)-2-[[(2R,3R,4R,5R)-5-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-3-Hydroxy-4-Phosphonooxy-Tetrahydrofuran-2-Yl]Methoxymethyl]-5-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-4-Ethyl-4-Hydroxy-Tetrahydrofuran-3-Yl]Oxyphosphinous Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H32N8O13P2++ |
| IUPAC Name | [(2r,3r,4r,5r)-2-[[(2r,3r,4r,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3-hydroxy-4-phosphonooxy-tetrahydrofuran-2-yl]methoxymethyl]-5-(4-amino-2-oxo-pyrimidin-3-ium-1-yl)-4-ethyl-4-hydroxy-tetrahydrofuran-3-yl]oxyphosphinous acid |
| Molecular Mass | 666.472 g·mol−1 |
| Heat of Formation | -2425.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.45 ± 1.08 D |
| Volume | 686.99 Å 3 |
| Surface Area | 517.55 Å 2 |
| HOMO Energy | -9.42 ± 0.55 eV |
| LUMO Energy | -1.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YXLLDZBPMYDELZ-AFFFXHIZSA-Q |
| 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 |