[(2R,3S,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C10H16N5O6P |
IUPAC Name | [(2r,3s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 333.238 g·mol−1 |
Heat of Formation | -1142.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.23 ± 1.08 D |
Volume | 341.76 Å 3 |
Surface Area | 304.21 Å 2 |
HOMO Energy | -8.96 ± 0.55 eV |
LUMO Energy | -0.70 ± eV |
Point Group Symmetry | C1 |
InChIKey | PZJDHBFJGGBLHQ-RRKCRQDMSA-O |
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Elements | P C H O N |