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Information card for entry 2243490
Preview
| Coordinates | 2243490.cif |
|---|---|
| Structure factors | 2243490.hkl |
| Original IUCr paper | HTML |
| Chemical name | Hexaaquanickel(II) bis[triaqua-μ~3~-oxalato-di-μ-oxalato-bariumchromate(III)] tetrahydrate |
|---|---|
| Formula | C12 H32 Ba2 Cr2 Ni O40 |
| Calculated formula | C12 H32 Ba2 Cr2 Ni O40 |
| Title of publication | Hexaaquanickel(II) bis[triaqua-μ~3~-oxalato-di-μ-oxalato-bariumchromate(III)] tetrahydrate |
| Authors of publication | Mbiangué, Yves Alain; Ndinga, Manelsa Lande; Nduga, Jean Pierre; Wenger, Emmanuel; Lecomte, Claude |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2020 |
| Journal volume | 76 |
| Journal issue | 8 |
| Pages of publication | 1316 - 1319 |
| a | 11.5556 ± 0.0011 Å |
| b | 11.0774 ± 0.0013 Å |
| c | 14.6105 ± 0.0017 Å |
| α | 90° |
| β | 93.794 ± 0.004° |
| γ | 90° |
| Cell volume | 1866.1 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0393 |
| Residual factor for significantly intense reflections | 0.0263 |
| Weighted residual factors for significantly intense reflections | 0.0537 |
| Weighted residual factors for all reflections included in the refinement | 0.0577 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 254388 (current) | 2020-07-18 | cif/ hkl/ Adding structures of 2243490 via cif-deposit CGI script. |
2243490.cif 2243490.hkl |
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Users of the data should acknowledge the original authors of the
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