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Information card for entry 7062176
Preview
| Coordinates | 7062176.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C99 H94 Cl6 Dy4 N7 O33 |
|---|---|
| Calculated formula | C99 H94 Cl6 Dy4 N7 O33 |
| SMILES | [Dy]12345(OC(=O)c6c(Cl)cccc6[N]5=Cc5c6[O]1[Dy]1789([O](c6ccc5)C)(OC(=O)c5c(Cl)cccc5[N]8=Cc5c(O1)c(OC)ccc5)[O]=C(O[Dy]1568(OC(=O)c%10c(Cl)cccc%10[N]8=Cc8c%10[O]1[Dy]1%11%12%13([O](c%10ccc8)C)([O]=C(O4)c4c(Cl)cccc4[N]%12=Cc4c([O]51)c([O]6C)ccc4)OC(=O)c1c(Cl)cccc1[N]%13=Cc1c(O%11)c(OC)ccc1)[OH2])c1c(Cl)cccc1[N]9=Cc1c([O]27)c([O]3C)ccc1)([OH2])[OH]C.OC.OC.OC.OC.OC.OC.N#CC |
| Title of publication | Asymmetric {Dy4} metallogrid and double-layered {Dy8} cage clusters from carboxylic decorated o-vanillin Schiff bases: syntheses, topological variation, and single molecule magnet behaviors |
| Authors of publication | Wang, Yi-Han; Qin, Yu; Tang, Shen; Teng, Qing-Hu; Zhu, Meng-Meng; Peng, Song; Wang, Kai; Liang, Fu-Pei |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2023 |
| Journal volume | 47 |
| Journal issue | 4 |
| Pages of publication | 2052 - 2059 |
| a | 29.0219 ± 0.0007 Å |
| b | 19.1466 ± 0.0005 Å |
| c | 19.2115 ± 0.0005 Å |
| α | 90° |
| β | 100.539 ± 0.003° |
| γ | 90° |
| Cell volume | 10495.2 ± 0.5 Å3 |
| Cell temperature | 100.01 K |
| Ambient diffraction temperature | 100.01 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1092 |
| Residual factor for significantly intense reflections | 0.0772 |
| Weighted residual factors for significantly intense reflections | 0.153 |
| Weighted residual factors for all reflections included in the refinement | 0.1723 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.176 |
| 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 |
|---|---|---|---|
| 281518 (current) | 2023-03-04 | cif/ Updating files of 7062176, 7062177 Original log message: Adding full bibliography for 7062176--7062177.cif. |
7062176.cif |
| 280012 | 2022-12-23 | cif/ Adding structures of 7062176, 7062177 via cif-deposit CGI script. |
7062176.cif |
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Users of the data should acknowledge the original authors of the
structural data.