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Information card for entry 7248346
Preview
| Coordinates | 7248346.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C33 H36 N4 O6 |
|---|---|
| Calculated formula | C33 H36 N4 O6 |
| Title of publication | Bilirubin and its crystal forms |
| Authors of publication | Bracken, Matthew L.; Fernandes, Manuel A.; Mathura, Sadhna |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 16 |
| Pages of publication | 2136 - 2142 |
| a | 11.663 ± 0.0007 Å |
| b | 15.3457 ± 0.0008 Å |
| c | 17.2204 ± 0.001 Å |
| α | 73.515 ± 0.002° |
| β | 81.274 ± 0.003° |
| γ | 82.823 ± 0.003° |
| Cell volume | 2910.2 ± 0.3 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1243 |
| Residual factor for significantly intense reflections | 0.0851 |
| Weighted residual factors for significantly intense reflections | 0.228 |
| Weighted residual factors for all reflections included in the refinement | 0.2681 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291594 (current) | 2024-05-05 | cif/ Updating files of 7248346, 7248347 Original log message: Adding full bibliography for 7248346--7248347.cif. |
7248346.cif |
| 290655 | 2024-03-27 | cif/ Adding structures of 7248346, 7248347 via cif-deposit CGI script. |
7248346.cif |
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Users of the data should acknowledge the original authors of the
structural data.