5-{3-Hydroxy-2-Methyl-5-[(Phosphonooxy)Methyl]-4-Pyridinyl}-2,4-Pyrrolidinedicarboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C13H17N2O9P |
| IUPAC Name | (2s,4r,5r)-5-[5-(dihydroxyphosphoryloxymethyl)-3-hydroxy-2-methyl-4-pyridyl]pyrrolidine-2,4-dicarboxylic acid |
| Molecular Mass | 376.256 g·mol−1 |
| Heat of Formation | -1908.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.64 ± 1.08 D |
| Volume | 387.41 Å 3 |
| Surface Area | 316.5 Å 2 |
| HOMO Energy | -9.15 ± 0.55 eV |
| LUMO Energy | -0.54 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AGPXAGRDCOKQID-NRPADANISA-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 |