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Information card for entry 2011453
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| Coordinates | 2011453.cif |
|---|---|
| Structure factors | 2011453.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(pyridinecarboxylato-O,N)(pyridinecarboxylic acid-O,N)manganese(III) hydroxide |
|---|---|
| Formula | C18 H14 Mn N3 O7 |
| Calculated formula | C18 H14 Mn N3 O7 |
| SMILES | [Mn]123(OC(=O)c4[n]1cccc4)([O]=C(O)c1[n]2cccc1)OC(=O)c1[n]3cccc1.[OH-] |
| Title of publication | Bis(pyridinecarboxylato-<i>O</i>,<i>N</i>)(pyridinecarboxylic acid-<i>O</i>,<i>N</i>)manganese(III) hydroxide |
| Authors of publication | Li, Yi-Zhi; Wang, Min; Wang, Liu-Fang; Xia, Chun-Gu |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 10 |
| Pages of publication | e445 - e446 |
| a | 30.523 ± 0.006 Å |
| b | 8.4111 ± 0.0017 Å |
| c | 13.914 ± 0.003 Å |
| α | 90° |
| β | 94.4 ± 0.03° |
| γ | 90° |
| Cell volume | 3561.6 ± 1.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.029 |
| Residual factor for significantly intense reflections | 0.029 |
| Weighted residual factors for all reflections included in the refinement | 0.067 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.86 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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