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Information card for entry 7054796
Preview
| Coordinates | 7054796.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H77 Dy Li N5 O Si6 |
|---|---|
| Calculated formula | C40 H77 Dy Li N5 O Si6 |
| SMILES | c12ccc3cccc4c3[n]2[Li]2([N](=C1)c1c(cccc1C(C)C)C(C)C)[N]([Dy](N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)[O]42)([Si](C)(C)C)[Si](C)(C)C |
| Title of publication | Heterometallic rare-earth metal complexes with imino-functionalized 8-hydroxyquinolyl ligands: synthesis, characterization and catalytic activity towards hydrophosphinylation of trans-β-nitroalkene |
| Authors of publication | Yuan, Qingbing; Zhou, Shuangliu; Zhu, Xiancui; Wei, Yun; Wang, Shaowu; Mu, Xiaolong; Yao, Fangshi; Zhang, Guangchao; Chen, Zheng |
| Journal of publication | New J. Chem. |
| Year of publication | 2015 |
| Journal volume | 39 |
| Journal issue | 10 |
| Pages of publication | 7626 |
| a | 15.5608 ± 0.0014 Å |
| b | 23.561 ± 0.002 Å |
| c | 33.081 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 12128.4 ± 1.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.1452 |
| Residual factor for significantly intense reflections | 0.0689 |
| Weighted residual factors for significantly intense reflections | 0.2024 |
| Weighted residual factors for all reflections included in the refinement | 0.2316 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7054796.cif |
| 162037 | 2015-10-09 | cif/ Updating files of 7054794, 7054795, 7054796, 7054797, 7054798, 7054799 Original log message: Adding full bibliography for 7054794--7054799.cif. |
7054796.cif |
| 135956 | 2015-05-09 | cif/ Adding structures of 7054794, 7054795, 7054796, 7054797, 7054798, 7054799 via cif-deposit CGI script. |
7054796.cif |
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