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Information card for entry 7247687
Preview
| Coordinates | 7247687.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H28 Cl4 Mn N2 O6 |
|---|---|
| Calculated formula | C10 H28 Cl4 Mn N2 O6 |
| Title of publication | The odd–even effect in n-carboxyalkylammonium-containing organic–inorganic hybrids of Mn(ii) halides: structural and magnetic characterisation |
| Authors of publication | Bothma, Shalene N.; Sheppard, Charles J.; Turnbull, Mark M.; Landee, Christopher P.; Rademeyer, Melanie |
| Journal of publication | CrystEngComm |
| Year of publication | 2023 |
| Journal volume | 25 |
| Journal issue | 47 |
| Pages of publication | 6568 - 6591 |
| a | 5.9046 ± 0.0004 Å |
| b | 7.8188 ± 0.0005 Å |
| c | 11.5638 ± 0.0007 Å |
| α | 91.74 ± 0.002° |
| β | 99.872 ± 0.002° |
| γ | 104.651 ± 0.002° |
| Cell volume | 507.33 ± 0.06 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0233 |
| Residual factor for significantly intense reflections | 0.0192 |
| Weighted residual factors for significantly intense reflections | 0.0459 |
| Weighted residual factors for all reflections included in the refinement | 0.0476 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288795 (current) | 2024-01-06 | cif/ Updating files of 7247685, 7247686, 7247687, 7247688 Original log message: Adding full bibliography for 7247685--7247688.cif. |
7247687.cif |
| 287494 | 2023-11-10 | cif/ Adding structures of 7247685, 7247686, 7247687, 7247688 via cif-deposit CGI script. |
7247687.cif |
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Users of the data should acknowledge the original authors of the
structural data.