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Information card for entry 7248347
Preview
| Coordinates | 7248347.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 | 11.8077 ± 0.001 Å |
| b | 15.022 ± 0.0012 Å |
| c | 19.3471 ± 0.0017 Å |
| α | 98.973 ± 0.003° |
| β | 104.421 ± 0.003° |
| γ | 111.029 ± 0.003° |
| Cell volume | 2985.8 ± 0.4 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 | 0.1867 |
| Residual factor for significantly intense reflections | 0.0948 |
| Weighted residual factors for significantly intense reflections | 0.224 |
| Weighted residual factors for all reflections included in the refinement | 0.2974 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| 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. |
7248347.cif |
| 290655 | 2024-03-27 | cif/ Adding structures of 7248346, 7248347 via cif-deposit CGI script. |
7248347.cif |
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Users of the data should acknowledge the original authors of the
structural data.