[[(2S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C10H18N5O12P3 |
IUPAC Name | [[(2s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
Molecular Mass | 493.197 g·mol−1 |
Heat of Formation | -2869.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.59 ± 1.08 D |
Volume | 465.82 Å 3 |
Surface Area | 395.64 Å 2 |
HOMO Energy | -9.09 ± 0.55 eV |
LUMO Energy | -1.39 ± eV |
Point Group Symmetry | C1 |
InChIKey | MZOGELCQFUNFCE-BAJZRUMYSA-O |
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 |