5'-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphorothioyl)Adenosine
Properties
Property | Value |
---|---|
Formula | C10H16N5O12P3S |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-sulfanyl-phosphoryl] phosphono hydrogen phosphate |
Molecular Mass | 523.247 g·mol−1 |
Heat of Formation | -1232.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.86 ± 1.08 D |
Volume | 459.42 Å 3 |
Surface Area | 404.95 Å 2 |
HOMO Energy | -9.99 ± 0.55 eV |
LUMO Energy | -3.00 ± eV |
Point Group Symmetry | C1 |
InChIKey | ROYJKVPBJVNHCQ-AJBXOXQOSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C S O N |