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Information card for entry 2204284
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| Coordinates | 2204284.cif |
|---|---|
| Structure factors | 2204284.hkl |
| Original IUCr paper | HTML |
| Formula | C11 H14 N4 O6 |
|---|---|
| Calculated formula | C11 H14 N4 O6 |
| Title of publication | Creatininium dipicolinate monohydrate |
| Authors of publication | Moghimi, S. Abolghasem; Sharif, Mahboubeh A.; Aghabozorg, Hossein |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2004 |
| Journal volume | 60 |
| Journal issue | 10 |
| Pages of publication | o1790 - o1792 |
| a | 13.485 ± 0.003 Å |
| b | 15.107 ± 0.003 Å |
| c | 6.515 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1327.2 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n a m |
| Hall space group symbol | -P 2c 2n |
| Residual factor for all reflections | 0.1152 |
| Residual factor for significantly intense reflections | 0.0483 |
| Weighted residual factors for significantly intense reflections | 0.1357 |
| Weighted residual factors for all reflections included in the refinement | 0.1624 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
Version history
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Users of the data should acknowledge the original authors of the
structural data.