[(2R,3S,4R,5S)-5-[(2R,3R,4R,5R)-2-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-3-Yl]Oxy-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
| Property | Value |
|---|---|
| Formula | C15H24N5O12P+ |
| IUPAC Name | [(2r,3s,4r,5s)-5-[(2r,3r,4r,5r)-2-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
| Molecular Mass | 497.351 g·mol−1 |
| Heat of Formation | -2186.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 10.11 ± 1.08 D |
| Volume | 514.36 Å 3 |
| Surface Area | 385.34 Å 2 |
| HOMO Energy | -9.39 ± 0.55 eV |
| LUMO Energy | -0.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HYFXLBZCNQUEHC-MHJQXXNXSA-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 |