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Information card for entry 2312690
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| Coordinates | 2312690.cif |
|---|---|
| Structure factors | 2312690.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[hexa-μ-acetato-(acetic acid)-μ~3~-oxido-<i>triangulo</i>-triiron(III)]-μ-acatato] |
|---|---|
| Formula | C16 H25 Fe3 O17 |
| Calculated formula | C16 H25 Fe3 O17 |
| Title of publication | A polymeric form of basic iron(III) acetate with an acetic acid ligand. |
| Authors of publication | Abrahams, Brendan F.; Robson, Richard; Commons, Christopher J. |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2024 |
| Journal volume | 80 |
| Journal issue | 12 |
| a | 15.8661 ± 0.0003 Å |
| b | 15.864 ± 0.0003 Å |
| c | 19.5003 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4908.22 ± 0.18 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.077 |
| Residual factor for significantly intense reflections | 0.0556 |
| Weighted residual factors for significantly intense reflections | 0.1422 |
| Weighted residual factors for all reflections included in the refinement | 0.1564 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296041 (current) | 2024-11-21 | cif/ hkl/ Adding structures of 2312690 via cif-deposit CGI script. |
2312690.cif 2312690.hkl |
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