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Information card for entry 2012570
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| Coordinates | 2012570.cif |
|---|---|
| Structure factors | 2012570.hkl |
| Original IUCr paper | HTML |
| Chemical name | pyridinium tetrachloro(oxo)pyridineniobate(V) pyridine solvate |
|---|---|
| Formula | C15 H16 Cl4 N3 Nb O |
| Calculated formula | C15 H16 Cl4 N3 Nb O |
| Title of publication | Pseudosymmetry in pyridinium tetrachloro(oxo)pyridineniobate(V) pyridine solvate |
| Authors of publication | Guzei, Ilia A.; Roberts, John; Saulys, Dovas A. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2002 |
| Journal volume | 58 |
| Journal issue | 3 |
| Pages of publication | m141 - m143 |
| a | 7.3355 ± 0.0003 Å |
| b | 9.4033 ± 0.0004 Å |
| c | 14.1728 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 977.61 ± 0.08 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 30 |
| Hermann-Mauguin space group symbol | P n c 2 |
| Hall space group symbol | P 2 -2bc |
| Residual factor for all reflections | 0.02 |
| Residual factor for significantly intense reflections | 0.02 |
| Weighted residual factors for significantly intense reflections | 0.054 |
| Weighted residual factors for all reflections included in the refinement | 0.054 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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