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Information card for entry 7241709
Preview
| Coordinates | 7241709.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H32 Cl4 Fe2 N16 O2 |
|---|---|
| Calculated formula | C34 H32 Cl4 Fe2 N16 O2 |
| Title of publication | The effect of halogen bonding on protonated hexacyanoferrate networks in hexacyanoferrates of halogenopyridines |
| Authors of publication | Jakupec, Nikola; Fotović, Luka; Stilinović, Vladimir |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| Journal volume | 22 |
| Journal issue | 46 |
| Pages of publication | 8142 - 8150 |
| a | 8.1771 ± 0.0009 Å |
| b | 11.2544 ± 0.0012 Å |
| c | 12.1692 ± 0.0015 Å |
| α | 91.426 ± 0.009° |
| β | 108.865 ± 0.01° |
| γ | 90.318 ± 0.009° |
| Cell volume | 1059.3 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0674 |
| Residual factor for significantly intense reflections | 0.0433 |
| Weighted residual factors for significantly intense reflections | 0.0742 |
| Weighted residual factors for all reflections included in the refinement | 0.0821 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259727 (current) | 2020-12-10 | cif/ Adding structures of 7241705, 7241706, 7241707, 7241708, 7241709, 7241710, 7241711 via cif-deposit CGI script. |
7241709.cif |
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Users of the data should acknowledge the original authors of the
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