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Information card for entry 1572440
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| Coordinates | 1572440.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | Norfloxacinium nitrate |
|---|---|
| Chemical name | 4-(3-Carboxy-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinolin-7-yl)piperazin-1-ium nitrate |
| Formula | C16 H19 F N4 O6 |
| Calculated formula | C16 H19 F N4 O6 |
| SMILES | Fc1cc2C(=O)C(=CN(c2cc1N1CC[NH2+]CC1)CC)C(=O)O.O=N(=O)[O-] |
| Title of publication | Norfloxacinium nitrate |
| Authors of publication | Rasulov, Abdusamat; Torambetov, Batirbay; Alimnazarov, Bekmurod; Kadirova, Shakhnoza; Suyunov, Jabbor; Nazarov, Yusufjon; Ashurov, Jamshid |
| Journal of publication | IUCrData |
| Year of publication | 2024 |
| Journal volume | 9 |
| Journal issue | 8 |
| Pages of publication | x240813 |
| a | 6.6241 ± 0.0001 Å |
| b | 19.1629 ± 0.0003 Å |
| c | 12.6062 ± 0.0002 Å |
| α | 90° |
| β | 93.136 ± 0.001° |
| γ | 90° |
| Cell volume | 1597.8 ± 0.04 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0522 |
| Residual factor for significantly intense reflections | 0.0455 |
| Weighted residual factors for significantly intense reflections | 0.12 |
| Weighted residual factors for all reflections included in the refinement | 0.1262 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300370 (current) | 2025-07-05 | Updating bibliography information from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis) |
1572440.cif |
| 294315 | 2024-08-31 | cif/ Adding structures of 1572440 via cif-deposit CGI script. |
1572440.cif |
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Users of the data should acknowledge the original authors of the
structural data.