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Information card for entry 7231126
Preview
| Coordinates | 7231126.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C30 H34 Br3 Dy N6 O8 |
|---|---|
| Calculated formula | C30 H34 Br3 Dy N6 O8 |
| Title of publication | Chiral and kryptoracemic Dy(iii) complexes with field-induced single molecule magnet behavior |
| Authors of publication | Zhang, Ying-Ying; Yu, Jing-Tao; Li, Bo; Li, De-Jing; Gu, Zhi-Gang; Sun, Xiao-Fan; Cai, Hong-Ling; Kostakis, George E.; Peng, Guo |
| Journal of publication | CrystEngComm |
| Year of publication | 2018 |
| Journal volume | 20 |
| Journal issue | 32 |
| Pages of publication | 4582 |
| a | 9.6 ± 0.0004 Å |
| b | 9.86 ± 0.0004 Å |
| c | 37.7277 ± 0.0017 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3571.2 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0654 |
| Residual factor for significantly intense reflections | 0.0451 |
| Weighted residual factors for significantly intense reflections | 0.0504 |
| Weighted residual factors for all reflections included in the refinement | 0.0534 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7231126.cif |
| 228924 | 2019-11-17 | cif/ Updating files of 7231126, 7231127 Original log message: Adding full bibliography for 7231126--7231127.cif. |
7231126.cif |
| 208986 | 2018-07-12 | cif/ Adding structures of 7231126, 7231127 via cif-deposit CGI script. |
7231126.cif |
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Users of the data should acknowledge the original authors of the
structural data.