4-Amino-1-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-5-Nitro-Pyrimidin-3-Ium-2-One
Properties
| Property | Value |
|---|---|
| Formula | C9H12N4O7+ |
| IUPAC Name | 4-amino-1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-nitro-pyrimidin-3-ium-2-one |
| Molecular Mass | 288.214 g·mol−1 |
| Heat of Formation | -827.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.23 ± 1.08 D |
| Volume | 296.59 Å 3 |
| Surface Area | 262.36 Å 2 |
| HOMO Energy | -10.39 ± 0.55 eV |
| LUMO Energy | -1.44 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BQYBPRIUTGECJI-UAKXSSHOSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |