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Information card for entry 1575697
Preview
| Coordinates | 1575697.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H18 N2 O S |
|---|---|
| Calculated formula | C26 H18 N2 O S |
| a | 9.232 ± 0.0007 Å |
| b | 9.3771 ± 0.0006 Å |
| c | 23.9503 ± 0.0017 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2073.4 ± 0.3 Å3 |
| Cell temperature | 297 ± 2 K |
| Ambient diffraction temperature | 297 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0422 |
| Residual factor for significantly intense reflections | 0.0396 |
| Weighted residual factors for significantly intense reflections | 0.1087 |
| Weighted residual factors for all reflections included in the refinement | 0.111 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.097 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302112 (current) | 2025-09-12 | cif/ Adding structures of 1575697 via cif-deposit CGI script. |
1575697.cif |
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Users of the data should acknowledge the original authors of the
structural data.