[(1R)-2-[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]-1-[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Ethyl] Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C19H24N7O12P++ |
IUPAC Name | [(1r)-2-[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-1-[(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]ethyl] dihydrogen phosphate |
Molecular Mass | 573.407 g·mol−1 |
Heat of Formation | -2138.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.53 ± 1.08 D |
Volume | 589.16 Å 3 |
Surface Area | 478.8 Å 2 |
HOMO Energy | -8.96 ± 0.55 eV |
LUMO Energy | -0.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | RUBULRDRXIJCRW-GRMSTWJFSA-Q |
QR Code | Generate QR Code |
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Elements | P C H O N |