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Information card for entry 1566177
Preview
| Coordinates | 1566177.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C59 H122 Ce4 Fe4 N10 O33 |
|---|---|
| Calculated formula | C59 H122 Ce4 Fe4 N10 O33 |
| Title of publication | Octanuclear heterometallic FeIII-CeIV pivalate clusters: From a close {Fe4Ce4(μ4-O)4} cage to an open {Fe4Ce4(μ4-O)2(μ3-O)2} core |
| Authors of publication | Baca, Svetlana G.; Amombo Noa, Francoise M.; Öhrström, Lars |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2021 |
| Journal volume | 515 |
| Pages of publication | 120038 |
| a | 12.20595 ± 0.00012 Å |
| b | 13.30987 ± 0.00016 Å |
| c | 15.93445 ± 0.00016 Å |
| α | 110.73 ± 0.001° |
| β | 98.5246 ± 0.0009° |
| γ | 110.735 ± 0.001° |
| Cell volume | 2150.71 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0331 |
| Residual factor for significantly intense reflections | 0.0305 |
| Weighted residual factors for significantly intense reflections | 0.0812 |
| Weighted residual factors for all reflections included in the refinement | 0.0827 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272290 (current) | 2022-01-27 | cif/ Adding structures of 1566177 via cif-deposit CGI script. |
1566177.cif |
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