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Information card for entry 2021332
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| Coordinates | 2021332.cif |
|---|---|
| Structure factors | 2021332.hkl |
| Original IUCr paper | HTML |
| Chemical name | Pentasodium iron(III) silicate |
|---|---|
| Formula | Fe Na4.96 O12 Si4 |
| Calculated formula | Fe Na4.96067 O12 Si4 |
| Title of publication | Structure and properties of Na~5~FeSi~4~O~12~ crystallized from 5Na~2~O‒Fe~2~O~3~‒8SiO~2~ glass |
| Authors of publication | Ahmadzadeh, Mostafa; Olds, Travis A.; Scrimshire, Alex; Bingham, Paul A.; McCloy, John S. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2018 |
| Journal volume | 74 |
| Journal issue | 12 |
| a | 21.418 ± 0.003 Å |
| b | 21.418 ± 0.003 Å |
| c | 12.2911 ± 0.0018 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 4882.9 ± 1.2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 167 |
| Hermann-Mauguin space group symbol | R -3 c |
| Hall space group symbol | -R 3 2"c |
| Residual factor for all reflections | 0.0308 |
| Residual factor for significantly intense reflections | 0.0192 |
| Weighted residual factors for significantly intense reflections | 0.0436 |
| Weighted residual factors for all reflections included in the refinement | 0.0458 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211917 (current) | 2018-11-13 | cif/ hkl/ Adding structures of 2021332 via cif-deposit CGI script. |
2021332.cif 2021332.hkl |
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