6-Amino-9-[5-O-(Hydroxy{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Phosphoryl)Pentofuranosyl]-7H-Purin-9-Ium
Properties
Property | Value |
---|---|
Formula | C10H17N5O13P3+ |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-amino-7,8-dihydropurine-1,3-diium-5,8-diid-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate |
Molecular Mass | 508.189 g·mol−1 |
Heat of Formation | -1257.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 14.03 ± 1.08 D |
Volume | 434.61 Å 3 |
Surface Area | 330.66 Å 2 |
HOMO Energy | -7.75 ± 0.55 eV |
LUMO Energy | -0.15 ± eV |
Point Group Symmetry | C1 |
InChIKey | WFSVITMLXASJHB-GAWUUDPSSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C O N |