[(3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-Tetrahydrofuran-3-Yl] Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C9H12N5O6P |
IUPAC Name | [(3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-tetrahydrofuran-3-yl] dihydrogen phosphate |
Molecular Mass | 317.195 g·mol−1 |
Heat of Formation | -1126.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.22 ± 1.08 D |
Volume | 314.26 Å 3 |
Surface Area | 285.53 Å 2 |
HOMO Energy | -9.19 ± 0.55 eV |
LUMO Energy | -0.64 ± eV |
Point Group Symmetry | C1 |
InChIKey | XVWAOBLUJLFELV-AFEQZKEHSA-O |
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Elements | P C H O N |