[[[(2R,3S,4R,5R)-3,4-Dihydroxy-5-(6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl]Oxy-Dihydroxy-Sulfido-Phosphonium
Properties
Property | Value |
---|---|
Formula | C10H18N4O13P3S+ |
IUPAC Name | [[[(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-oxo-3h-purine-1,7-diium-4-id-9-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-dihydroxy-sulfido-phosphonium |
Molecular Mass | 527.255 g·mol−1 |
Heat of Formation | -2975.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 13.76 ± 1.08 D |
Volume | 493.76 Å 3 |
Surface Area | 381.26 Å 2 |
HOMO Energy | -8.63 ± 0.55 eV |
LUMO Energy | -1.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | GTYITFKJOHNQMI-KQYNXXCUSA-P |
QR Code | Generate QR Code |
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Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C H O N P S |