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Information card for entry 8101737
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Coordinates | 8101737.cif |
---|
Formula | C22 H21 F N6 O10 |
---|---|
Calculated formula | C22 H21 F N6 O10 |
SMILES | Fc1cc2c(n(cc(C(=O)O)c2=O)CC)cc1N1CC[NH2+]CC1.O=N(=O)c1cc(N(=O)=O)cc(N(=O)=O)c1[O-] |
Title of publication | Crystal structure of norfloxacin picrate, (C~16~H~19~FN~3~O~3~)[C~6~H~2~ (NO~2~)~3~O] |
Authors of publication | R.-D. Hu; Q.-S. Yu |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2005 |
Journal volume | 220 |
Journal issue | 2 |
Pages of publication | 171 - 172 |
a | 8.644 ± 0.001 Å |
b | 9.94 ± 0.001 Å |
c | 13.915 ± 0.001 Å |
α | 74.954 ± 0.007° |
β | 85.014 ± 0.004° |
γ | 86.633 ± 0.007° |
Cell volume | 1149.4 ± 0.2 Å3 |
Cell temperature | 293 ± 1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for significantly intense reflections | 0.059 |
Weighted residual factors for all reflections included in the refinement | 0.167 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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