1-{5-O-[Hydroxy(Phosphonomethyl)Phosphoryl]Pentofuranosyl}-2,4(1H,3H)-Pyrimidinedione
Properties
Property | Value |
---|---|
Formula | C10H16N2O11P2 |
IUPAC Name | [[(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]methylphosphonic acid |
Molecular Mass | 402.188 g·mol−1 |
Heat of Formation | -2404.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.85 ± 1.08 D |
Volume | 402.42 Å 3 |
Surface Area | 356.8 Å 2 |
HOMO Energy | -9.98 ± 0.55 eV |
LUMO Energy | -0.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | PDEGDTTUBZXACY-ZOQUXTDFSA-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 |