2-[(E)-[1-[(2R,3S,4S,5R)-3,4-Dihydroxy-5-(Phosphonooxymethyl)Tetrahydrofuran-2-Yl]-4-Oxo-2-Thioxo-Pyrimidin-5-Yl]Methyleneamino]Acetic Acid
Properties
| Property | Value |
|---|---|
| Formula | C12H16N3O10PS |
| IUPAC Name | 2-[(e)-[1-[(2r,3s,4s,5r)-3,4-dihydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]-4-oxo-2-thioxo-pyrimidin-5-yl]methyleneamino]acetic acid |
| Molecular Mass | 425.308 g·mol−1 |
| Heat of Formation | -1925.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.03 ± 1.08 D |
| Volume | 432.48 Å 3 |
| Surface Area | 362.55 Å 2 |
| HOMO Energy | -9.06 ± 0.55 eV |
| LUMO Energy | 1.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OIOFJGQNCGWJPT-PDCDXKGCSA-P |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N P S |