[[5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [5-(3-Carbamoyl-3,4-Dihydro-2H-Pyridin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C21H31N7O14P2 |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-[(3r)-3-carbamoyl-3,4-dihydro-2h-pyridin-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate |
Molecular Mass | 667.457 g·mol−1 |
Heat of Formation | -2820.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.38 ± 1.08 D |
Volume | 693.09 Å 3 |
Surface Area | 566.86 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | -1.46 ± eV |
Point Group Symmetry | C1 |
InChIKey | FDIVXUDDFSHSAE-MTKBYBFRSA-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 |