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Information card for entry 7231803
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| Coordinates | 7231803.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Dibromo-bis(3-cyanopyridine)nickelat |
|---|---|
| Chemical name | alpha-Catena-dibromo-di(3-cyanopyridine)nickelat |
| Formula | C12 H8 Br2 N4 Ni |
| Calculated formula | C12 H8 Br2 N4 Ni |
| Title of publication | 3-Cyanopyridine as a bridging and terminal ligand in coordination polymers |
| Authors of publication | Heine, Miriam; Fink, Lothar; Schmidt, Martin U. |
| Journal of publication | CrystEngComm |
| Year of publication | 2018 |
| Journal volume | 20 |
| Journal issue | 46 |
| Pages of publication | 7556 |
| a | 3.709 ± 0.001 Å |
| b | 26.801 ± 0.004 Å |
| c | 13.706 ± 0.008 Å |
| α | 90° |
| β | 97.678 ± 0.006° |
| γ | 90° |
| Cell volume | 1350.2 ± 0.9 Å3 |
| Cell temperature | 198 K |
| Ambient diffraction temperature | 198 K |
| Number of distinct elements | 5 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor R(I) for significantly intense reflections | 0.00446 |
| Goodness-of-fit parameter for all reflections | 1.825 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 1.5406 Å |
| Diffraction radiation type | CuKα~1~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287932 (current) | 2023-12-01 | cif/ Removed the '_space_group' data item from multiple entries since it is not defined in the official IUCr dictionaries and the same information is already expressed using different data items. |
7231803.cif |
| 229027 | 2019-11-17 | cif/ Updating files of 7231797, 7231798, 7231799, 7231800, 7231801, 7231802, 7231803, 7231804, 7231805, 7231806, 7231807, 7231808 Original log message: Adding full bibliography for 7231797--7231808.cif. |
7231803.cif |
| 211956 | 2018-11-15 | cif/ Adding structures of 7231803 via cif-deposit CGI script. |
7231803.cif |
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Users of the data should acknowledge the original authors of the
structural data.