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Information card for entry 7058138
Preview
| Coordinates | 7058138.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H48 N3 O4 Tb |
|---|---|
| Calculated formula | C36 H48 N3 O4 Tb |
| Title of publication | TbIII/3d–TbIII clusters derived from a 1,4,7-triazacyclononane-based hexadentate ligand with field-induced slow magnetic relaxation and oxygen-sensitive luminescence |
| Authors of publication | Wen, He-Rui; Zhang, Jia-Li; Liang, Fu-Yong; Yang, Kai; Liu, Sui-Jun; Liao, Jin-Sheng; Liu, Cai-Ming |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2019 |
| Journal volume | 43 |
| Journal issue | 10 |
| Pages of publication | 4067 |
| a | 7.904 ± 0.0003 Å |
| b | 14.7738 ± 0.0006 Å |
| c | 16.2199 ± 0.0007 Å |
| α | 109.165 ± 0.001° |
| β | 99.776 ± 0.001° |
| γ | 100.712 ± 0.001° |
| Cell volume | 1702.65 ± 0.12 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 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 | 0.0411 |
| Residual factor for significantly intense reflections | 0.029 |
| Weighted residual factors for significantly intense reflections | 0.0579 |
| Weighted residual factors for all reflections included in the refinement | 0.0607 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7058138.cif |
| 224692 | 2019-11-08 | cif/ Updating files of 7058136, 7058137, 7058138, 7058139 Original log message: Adding full bibliography for 7058136--7058139.cif. |
7058138.cif |
| 213451 | 2019-02-03 | cif/ Adding structures of 7058136, 7058137, 7058138, 7058139 via cif-deposit CGI script. |
7058138.cif |
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Users of the data should acknowledge the original authors of the
structural data.