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Information card for entry 1573675
Preview
| Coordinates | 1573675.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H32 B20 N2 S2 |
|---|---|
| Calculated formula | C18 H32 B20 N2 S2 |
| a | 12.0591 ± 0.0009 Å |
| b | 10.8146 ± 0.0009 Å |
| c | 45.473 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5930.3 ± 0.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.1227 |
| Residual factor for significantly intense reflections | 0.0695 |
| Weighted residual factors for significantly intense reflections | 0.1413 |
| Weighted residual factors for all reflections included in the refinement | 0.1673 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297252 (current) | 2025-01-10 | cif/ Adding structures of 1573667, 1573668, 1573669, 1573670, 1573671, 1573672, 1573673, 1573674, 1573675, 1573676 via cif-deposit CGI script. |
1573675.cif |
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Users of the data should acknowledge the original authors of the
structural data.