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Information card for entry 2107479
Preview
| Coordinates | 2107479.cif |
|---|---|
| Structure factors | 2107479.hkl |
| Original IUCr paper | HTML |
| Formula | Cr Fe O3 |
|---|---|
| Calculated formula | Cr Fe O3 |
| Title of publication | At last! The single-crystal X-ray structure of a naturally occurring sample of the ilmenite-type oxide FeCrO~3~ |
| Authors of publication | Pérez-Cruz, María Ana; Elizalde-González, María de la Paz; Escudero, Roberto; Bernès, Sylvain; Silva-González, Rutilo; Reyes-Ortega, Yasmi |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 5 |
| Pages of publication | 555 - 561 |
| a | 5.077 ± 0.0004 Å |
| b | 5.077 ± 0.0004 Å |
| c | 13.9621 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 311.67 ± 0.05 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 1 K |
| Number of distinct elements | 3 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 :H |
| Hall space group symbol | -R 3 |
| Residual factor for all reflections | 0.0236 |
| Residual factor for significantly intense reflections | 0.0202 |
| Weighted residual factors for significantly intense reflections | 0.0565 |
| Weighted residual factors for all reflections included in the refinement | 0.0592 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.114 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181885 (current) | 2016-04-06 | hkl/2/10/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/10/74. |
2107479.cif 2107479.hkl |
| 178106 | 2016-03-11 | cif/ hkl/ Adding structures of 2107479 via cif-deposit CGI script. |
2107479.cif 2107479.hkl |
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Users of the data should acknowledge the original authors of the
structural data.