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Information card for entry 1564498
Preview
| Coordinates | 1564498.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H24 Br2 Co N4 S2 |
|---|---|
| Calculated formula | C10 H24 Br2 Co N4 S2 |
| Title of publication | Quantifying magnetic anisotropy using X-ray and neutron diffraction |
| Authors of publication | Klahn, Emil Andreasen; Damgaard-Møller, Emil; Krause, Lennard; Kibalin, Iurii; Gukasov, Arsen; Tripathi, Shalini; Swain, Abinash; Shanmugam, Maheswaran; Overgaard, Jacob |
| Journal of publication | IUCrJ |
| Year of publication | 2021 |
| Journal volume | 8 |
| Journal issue | 5 |
| a | 9.798 ± 0.004 Å |
| b | 12.961 ± 0.008 Å |
| c | 14.636 ± 0.006 Å |
| α | 90° |
| β | 92.363 ± 0.008° |
| γ | 90° |
| Cell volume | 1857.1 ± 1.6 Å3 |
| Cell temperature | 20 ± 2 K |
| Ambient diffraction temperature | 20 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.056 |
| Residual factor for significantly intense reflections | 0.014 |
| Weighted residual factors for all reflections included in the refinement | 0.029 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
| Diffraction radiation wavelength | 0.2486 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 268341 (current) | 2021-09-01 | cif/ Adding structures of 1564497, 1564498 via cif-deposit CGI script. |
1564498.cif |
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