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Information card for entry 1575469
Preview
| Coordinates | 1575469.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H20 I N O3 |
|---|---|
| Calculated formula | C13 H20 I N O3 |
| a | 8.5894 ± 0.0002 Å |
| b | 16.0241 ± 0.0004 Å |
| c | 10.5135 ± 0.0003 Å |
| α | 90° |
| β | 92.256 ± 0.002° |
| γ | 90° |
| Cell volume | 1445.93 ± 0.06 Å3 |
| Cell temperature | 120.01 ± 0.1 K |
| Ambient diffraction temperature | 120.01 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0188 |
| Residual factor for significantly intense reflections | 0.0181 |
| Weighted residual factors for significantly intense reflections | 0.0414 |
| Weighted residual factors for all reflections included in the refinement | 0.0419 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| 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 |
|---|---|---|---|
| 301757 (current) | 2025-08-16 | cif/ Adding structures of 1575468, 1575469, 1575470, 1575471, 1575472, 1575473, 1575474, 1575475, 1575476 via cif-deposit CGI script. |
1575469.cif |
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Users of the data should acknowledge the original authors of the
structural data.