5'-O-{[(4-Chlorobenzoyl)Oxy](Hydroxy)Phosphoryl}Adenosine
Properties
Property | Value |
---|---|
Formula | C17H17ClN5O8P |
IUPAC Name | [[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] 4-chlorobenzoate |
Molecular Mass | 485.772 g·mol−1 |
Heat of Formation | -1445.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.88 ± 1.08 D |
Volume | 494.03 Å 3 |
Surface Area | 358.22 Å 2 |
HOMO Energy | -9.20 ± 0.55 eV |
LUMO Energy | -1.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | RVDNKWBGRIIRML-XNIJJKJLSA-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 |