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Information card for entry 2242786
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| Coordinates | 2242786.cif |
|---|---|
| Structure factors | 2242786.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[hexaaquatris(μ-3,6-dioxocyclohexa-1,4-diene-1,4-diolato)dierbium(III)] octadecahydrate] |
|---|---|
| Formula | C18 H54 Er2 O36 |
| Calculated formula | C18 H54 Er2 O36 |
| Title of publication | Crystal structure of poly[[hexaaquatris(μ-3,6-dioxocyclohexa-1,4-diene-1,4-diolato)dierbium(III)] octadecahydrate] |
| Authors of publication | Ponjan, Nutcha; Kodchasanthong, Kenika; Jiajaroen, Suwadee; Chainok, Kittipong |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 1 |
| Pages of publication | 64 - 67 |
| a | 14.0947 ± 0.0003 Å |
| b | 14.0947 ± 0.0003 Å |
| c | 18.0603 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 3107.19 ± 0.13 Å3 |
| Cell temperature | 296 K |
| Ambient diffraction temperature | 296 K |
| Number of distinct elements | 4 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 |
| Hall space group symbol | -R 3 |
| Residual factor for all reflections | 0.0372 |
| Residual factor for significantly intense reflections | 0.023 |
| Weighted residual factors for significantly intense reflections | 0.0362 |
| Weighted residual factors for all reflections included in the refinement | 0.0416 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 212635 (current) | 2018-12-18 | cif/ hkl/ Adding structures of 2242786 via cif-deposit CGI script. |
2242786.cif 2242786.hkl |
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Users of the data should acknowledge the original authors of the
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