2-Chloro-5'-O-[Hydroxy(Phosphonomethyl)Phosphoryl]Adenosine
Properties
Property | Value |
---|---|
Formula | C11H16ClN5O9P2 |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-amino-2-chloro-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]methylphosphonic acid |
Molecular Mass | 459.673 g·mol−1 |
Heat of Formation | -1901.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.71 ± 1.08 D |
Volume | 441.01 Å 3 |
Surface Area | 353.6 Å 2 |
HOMO Energy | -8.91 ± 0.55 eV |
LUMO Energy | 2.50 ± eV |
Point Group Symmetry | C1 |
InChIKey | INCBEFXULMHULH-FCIPNVEPSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C Cl H O N P |