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Information card for entry 1559887
Preview
| Coordinates | 1559887.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H14 N2 Ni O2 |
|---|---|
| Calculated formula | C20 H14 N2 Ni O2 |
| SMILES | [Ni]123Oc4c(C=[N]3c3c([N]2=Cc2c(O1)cccc2)cccc3)cccc4 |
| Title of publication | Multiweek Experiments for an Inorganic Chemistry Laboratory Course: Synthesis of Nickel Complexes Supported by a Tetradentate Ligand with a N2O2 Donor Set |
| Authors of publication | Collett, Joel D.; Krause, Jeanette A.; Guan, Hairong |
| Journal of publication | Journal of Chemical Education |
| Year of publication | 2020 |
| a | 5.36239 ± 0.00009 Å |
| b | 16.6313 ± 0.0003 Å |
| c | 17.2165 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1535.43 ± 0.05 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0245 |
| Residual factor for significantly intense reflections | 0.0236 |
| Weighted residual factors for significantly intense reflections | 0.0607 |
| Weighted residual factors for all reflections included in the refinement | 0.0613 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 260275 (current) | 2020-12-31 | cif/ Adding structures of 1559887 via cif-deposit CGI script. |
1559887.cif |
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