[(2S,3S,4R,5R)-3-Amino-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C10H18N6O9P2 |
IUPAC Name | [(2s,3s,4r,5r)-3-amino-5-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate |
Molecular Mass | 428.232 g·mol−1 |
Heat of Formation | -2013.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.49 ± 1.08 D |
Volume | 417.08 Å 3 |
Surface Area | 350.47 Å 2 |
HOMO Energy | -9.21 ± 0.55 eV |
LUMO Energy | 1.75 ± eV |
Point Group Symmetry | C1 |
InChIKey | CIRFSJCEHGAMJB-QYYRPYCUSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |