[(2R,3R,4R,5R)-5-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-4-Fluoro-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] [(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C19H25FN7O12P+++ |
| IUPAC Name | [(2r,3r,4r,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-yl] [(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Molecular Mass | 593.414 g·mol−1 |
| Heat of Formation | -2295.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.17 ± 1.08 D |
| Volume | 600.28 Å 3 |
| Surface Area | 422.06 Å 2 |
| HOMO Energy | -9.38 ± 0.55 eV |
| LUMO Energy | -1.05 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VNDBOBPMCPHBME-FOJQSULLSA-R |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N P |