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Information card for entry 7225191
Preview
| Coordinates | 7225191.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | tetra(acetato)-tetra(chrysazinato)-tetra(N,N-dimethylformamide)-hexa-nickel(II) bis(N,N-dimethylformamide) solvate |
|---|---|
| Formula | C88 H92 N8 Ni6 O32 |
| Calculated formula | C88 H92 N8 Ni6 O32 |
| Title of publication | Transition metal coordination complexes of chrysazin |
| Authors of publication | Beldon, Patrick J.; Henke, Sebastian; Monserrat, Bartomeu; Tominaka, Satoshi; Stock, Norbert; Cheetham, Anthony K. |
| Journal of publication | CrystEngComm |
| Year of publication | 2016 |
| Journal volume | 18 |
| Journal issue | 27 |
| Pages of publication | 5121 |
| a | 9.7302 ± 0.0006 Å |
| b | 13.4388 ± 0.0005 Å |
| c | 17.0848 ± 0.0007 Å |
| α | 95.504 ± 0.003° |
| β | 97.873 ± 0.004° |
| γ | 95.172 ± 0.004° |
| Cell volume | 2190.67 ± 0.18 Å3 |
| Cell temperature | 200 ± 0.14 K |
| Ambient diffraction temperature | 200 ± 0.14 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 all reflections | 0.0719 |
| Residual factor for significantly intense reflections | 0.0598 |
| Weighted residual factors for significantly intense reflections | 0.166 |
| Weighted residual factors for all reflections included in the refinement | 0.181 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301865 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/22/ Each referenced PubChem compound corresponds to the full crystal structure. |
7225191.cif |
| 185227 | 2016-08-07 | cif/ Updating files of 7225182, 7225183, 7225184, 7225185, 7225186, 7225187, 7225188, 7225189, 7225190, 7225191, 7225192 Original log message: Adding full bibliography for 7225182--7225192.cif. |
7225191.cif |
| 182887 | 2016-05-12 | cif/ Adding structures of 7225182, 7225183, 7225184, 7225185, 7225186, 7225187, 7225188, 7225189, 7225190, 7225191, 7225192 via cif-deposit CGI script. |
7225191.cif |
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Users of the data should acknowledge the original authors of the
structural data.