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Information card for entry 7247746
Preview
| Coordinates | 7247746.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H48 Mn4 N4 O20 |
|---|---|
| Calculated formula | C42 H48 Mn4 N4 O20 |
| Title of publication | Assembly of MnIII ions into di-, tetra-, deca-nuclear coordination complexes, zero- to three-dimensional molecular frameworks: molecular spin flop to and short-range bulk magnetic spin flop ordering |
| Authors of publication | Kumar, Jayasree; Tarannum, Ibtesham; Zheng, Yan-Zhen; Singh, Saurabh Kumar; Mondal, Kartik Chandra |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 1 |
| Pages of publication | 80 - 99 |
| a | 10.5827 ± 0.0006 Å |
| b | 11.1323 ± 0.0007 Å |
| c | 12.6983 ± 0.0008 Å |
| α | 104.061 ± 0.003° |
| β | 113.978 ± 0.003° |
| γ | 90.275 ± 0.003° |
| Cell volume | 1316.85 ± 0.14 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0874 |
| Residual factor for significantly intense reflections | 0.0512 |
| Weighted residual factors for significantly intense reflections | 0.1236 |
| Weighted residual factors for all reflections included in the refinement | 0.1513 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.82 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 289435 (current) | 2024-02-04 | cif/ Updating files of 7247746, 7247747, 7247748, 7247749 Original log message: Adding full bibliography for 7247746--7247749.cif. |
7247746.cif |
| 287658 | 2023-11-17 | cif/ Adding structures of 7247746, 7247747, 7247748, 7247749 via cif-deposit CGI script. |
7247746.cif |
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Users of the data should acknowledge the original authors of the
structural data.