2-Amino-9-{5-O-[(R)-Hydroxy(Phosphonooxy)Phosphoryl]-3-O-Phosphono-α-L-Arabinofuranosyl}-1,9-Dihydro-6H-Purin-6-One
Properties
Property | Value |
---|---|
Formula | C10H18N5O14P3+ |
IUPAC Name | [(2s,3r,4r,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate |
Molecular Mass | 525.196 g·mol−1 |
Heat of Formation | -3214.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 17.61 ± 1.08 D |
Volume | 487.39 Å 3 |
Surface Area | 389.77 Å 2 |
HOMO Energy | -8.87 ± 0.55 eV |
LUMO Energy | -1.82 ± eV |
Point Group Symmetry | C1 |
InChIKey | HEYSFDAMRDTCJM-FULWYAMNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |