[[5-(6-Aminopurin-9-Yl)-3-Hydroxy-4-Phosphonooxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [5-(3-Carbamoyl-3,6-Dihydro-2H-Pyridin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C21H12N7O17P3 |
IUPAC Name | [[5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [5-(3-carbamoyl-3,6-dihydro-2h-pyridin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
Molecular Mass | 727.278 g·mol−1 |
Heat of Formation | -321.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.53 ± 1.08 D |
Volume | 687.89 Å 3 |
Surface Area | 583.66 Å 2 |
HOMO Energy | -8.81 ± 0.55 eV |
LUMO Energy | -2.87 ± eV |
Point Group Symmetry | C1 |
InChIKey | MGWIKFWDIJJFDG-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C O N |