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Information card for entry 1573820
Preview
| Coordinates | 1573820.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C71 H79 Br3 Cl N19 Ni3 O9 |
|---|---|
| Calculated formula | C71 H77 Br3 Cl N19 Ni3 O9 |
| Title of publication | Spin Interactions and Magnetic Anisotropy in a Triangular Nickel(II) Complex with Triaminoguanidine Ligand Framework |
| Authors of publication | Michael Böhme; Dirk Schuch; Axel Buchholz; Helmar Görls; Winfried Plass |
| Journal of publication | Zeitschrift fuer Anorganische und Allgemeine Chemie |
| Year of publication | 2020 |
| Journal volume | 646 |
| Journal issue | 3 |
| Pages of publication | 166 - 174 |
| a | 12.5258 ± 0.0004 Å |
| b | 18.0165 ± 0.0007 Å |
| c | 20.8704 ± 0.0009 Å |
| α | 70.691 ± 0.002° |
| β | 73.096 ± 0.002° |
| γ | 84.678 ± 0.002° |
| Cell volume | 4252.8 ± 0.3 Å3 |
| Cell temperature | 183 ± 2 K |
| Ambient diffraction temperature | 183 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1375 |
| Residual factor for significantly intense reflections | 0.0699 |
| Weighted residual factors for significantly intense reflections | 0.1643 |
| Weighted residual factors for all reflections included in the refinement | 0.1983 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297546 (current) | 2025-01-31 | cif/ Adding structures of 1573820 via cif-deposit CGI script. |
1573820.cif |
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