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Information card for entry 7247897
Preview
| Coordinates | 7247897.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H30.5 Cl2 Fe N8 O10.25 |
|---|---|
| Calculated formula | C20 H30.5 Cl2 Fe N8 O10.25 |
| Title of publication | Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers |
| Authors of publication | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 4 |
| Pages of publication | 504 - 516 |
| a | 10.0299 ± 0.0012 Å |
| b | 13.9025 ± 0.0017 Å |
| c | 19.959 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2783.1 ± 0.6 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0798 |
| Residual factor for significantly intense reflections | 0.0615 |
| Weighted residual factors for significantly intense reflections | 0.1639 |
| Weighted residual factors for all reflections included in the refinement | 0.1765 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 289442 (current) | 2024-02-04 | cif/ Updating files of 7247889, 7247890, 7247891, 7247892, 7247893, 7247894, 7247895, 7247896, 7247897, 7247898 Original log message: Adding full bibliography for 7247889--7247898.cif. |
7247897.cif |
| 288490 | 2023-12-22 | cif/ Adding structures of 7247889, 7247890, 7247891, 7247892, 7247893, 7247894, 7247895, 7247896, 7247897, 7247898 via cif-deposit CGI script. |
7247897.cif |
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Users of the data should acknowledge the original authors of the
structural data.