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Information card for entry 1575692
Preview
| Coordinates | 1575692.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H28 F6 N2 O4 Ti |
|---|---|
| Calculated formula | C38 H28 F6 N2 O4 Ti |
| a | 11.0169 ± 0.0006 Å |
| b | 21.8914 ± 0.0012 Å |
| c | 13.9563 ± 0.0007 Å |
| α | 90° |
| β | 95.792 ± 0.002° |
| γ | 90° |
| Cell volume | 3348.7 ± 0.3 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0355 |
| Residual factor for significantly intense reflections | 0.0352 |
| Weighted residual factors for significantly intense reflections | 0.0942 |
| Weighted residual factors for all reflections included in the refinement | 0.0945 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302100 (current) | 2025-09-11 | cif/ Adding structures of 1575690, 1575691, 1575692 via cif-deposit CGI script. |
1575692.cif |
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Users of the data should acknowledge the original authors of the
structural data.