6-Ethoxy-9-[(2R,4Ar,6R,7R,7Ar)-7-Fluoro-2-Isopropoxy-7-Methyl-2-Oxidotetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-6-Yl]-9H-Purin-2-Amine
Properties
Property | Value |
---|---|
Formula | C16H23FN5O6P |
IUPAC Name | 9-[(2r,4ar,6r,7r,7ar)-7-fluoro-2-isopropoxy-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-ethoxy-purin-9-ium-2-amine |
Molecular Mass | 431.356 g·mol−1 |
Heat of Formation | -1295.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.39 ± 1.08 D |
Volume | 463.03 Å 3 |
Surface Area | 389.45 Å 2 |
HOMO Energy | -8.82 ± 0.55 eV |
LUMO Energy | 2.65 ± eV |
Point Group Symmetry | C1 |
InChIKey | PVRFQJIRERYGTQ-MVXGGCNYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F H O N P |