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Information card for entry 7049532
Preview
| Coordinates | 7049532.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C74 H92 B4 O5 U |
|---|---|
| Calculated formula | C74 H92 B4 O5 U |
| Title of publication | Applications of boroxide ligands in supporting small molecule activation by U(iii) and U(iv) complexes. |
| Authors of publication | Arnold, Polly L.; Puig-Urrea, Laura; Wells, Jordann A. L.; Yuan, Dan; Cruickshank, Faye L.; Young, Rowan D. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 15 |
| Pages of publication | 4894 - 4905 |
| a | 14.1285 ± 0.001 Å |
| b | 15.8427 ± 0.0012 Å |
| c | 16.6496 ± 0.0012 Å |
| α | 103.798 ± 0.006° |
| β | 105.012 ± 0.006° |
| γ | 98.607 ± 0.006° |
| Cell volume | 3405.7 ± 0.5 Å3 |
| Cell temperature | 170 ± 0 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1047 |
| Residual factor for significantly intense reflections | 0.0688 |
| Weighted residual factors for significantly intense reflections | 0.0782 |
| Weighted residual factors for all reflections included in the refinement | 0.087 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
| 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 |
|---|---|---|---|
| 301850 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure. |
7049532.cif |
| 224395 | 2019-11-08 | cif/ Updating files of 7049530, 7049531, 7049532, 7049533, 7049534, 7049535, 7049536, 7049537, 7049538, 7049539 Original log message: Adding full bibliography for 7049530--7049539.cif. |
7049532.cif |
| 214420 | 2019-03-30 | cif/ Adding structures of 7049530, 7049531, 7049532, 7049533, 7049534, 7049535, 7049536, 7049537, 7049538, 7049539 via cif-deposit CGI script. |
7049532.cif |
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Users of the data should acknowledge the original authors of the
structural data.