5'-O-(Hydroxy{[Hydroxy({Hydroxy[1-(2-Nitrophenyl)Ethoxy]Phosphoryl}Oxy)Phosphoryl]Oxy}Phosphoryl)Adenosine
Properties
Property | Value |
---|---|
Formula | C18H23N6O15P3 |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [hydroxy-[(1s)-1-(2-nitrophenyl)ethoxy]phosphoryl] hydrogen phosphate |
Molecular Mass | 656.328 g·mol−1 |
Heat of Formation | -3007.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.62 ± 1.08 D |
Volume | 654.03 Å 3 |
Surface Area | 451.8 Å 2 |
HOMO Energy | -8.97 ± 0.55 eV |
LUMO Energy | -1.71 ± eV |
Point Group Symmetry | C1 |
InChIKey | UOLVQBSMMHANLG-YBGGAFRISA-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 |