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Information card for entry 1550516
Preview
| Coordinates | 1550516.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C125.2 H184.5 As5 Br14.55 Cl6.8 Cr2 Cu14.55 Fe11 N0.9 P55 |
|---|---|
| Calculated formula | C125.2 H184.5 As5 Br14.55 Cl6.8 Cr2 Cu14.55 Fe11 N0.9 P55 |
| Title of publication | From Nano-Balls to Nano-Bowls |
| Authors of publication | Brake, Helena; Presypkina, Eugenia V.; Heindl, Claudia; Virovets, Alexander Viktorovich; Kremer, Werner; Scheer, Manfred |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 27.08802 ± 0.00013 Å |
| b | 33.62013 ± 0.00012 Å |
| c | 25.36593 ± 0.00011 Å |
| α | 90° |
| β | 103.351 ± 0.0005° |
| γ | 90° |
| Cell volume | 22476.5 ± 0.17 Å3 |
| Cell temperature | 80 ± 2 K |
| Ambient diffraction temperature | 80 ± 2 K |
| Number of distinct elements | 10 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0483 |
| Residual factor for significantly intense reflections | 0.0395 |
| Weighted residual factors for significantly intense reflections | 0.1057 |
| Weighted residual factors for all reflections included in the refinement | 0.1076 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.6199 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213266 (current) | 2019-01-24 | cif/ Adding structures of 1550514, 1550515, 1550516 via cif-deposit CGI script. |
1550516.cif |
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