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Information card for entry 1573813
Preview
| Coordinates | 1573813.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C74 H58 In2 N4 O12 S12 |
|---|---|
| Calculated formula | C74 H58 In2 N4 O12 S12 |
| a | 28.2437 ± 0.0006 Å |
| b | 17.5038 ± 0.0003 Å |
| c | 14.8073 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7320.3 ± 0.2 Å3 |
| Cell temperature | 99.98 ± 0.18 K |
| Ambient diffraction temperature | 99.98 ± 0.18 K |
| Number of distinct elements | 6 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.0978 |
| Residual factor for significantly intense reflections | 0.057 |
| Weighted residual factors for significantly intense reflections | 0.1231 |
| Weighted residual factors for all reflections included in the refinement | 0.1436 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297532 (current) | 2025-01-30 | cif/ Adding structures of 1573811, 1573812, 1573813 via cif-deposit CGI script. |
1573813.cif |
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Users of the data should acknowledge the original authors of the
structural data.