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Information card for entry 7036949
Preview
| Coordinates | 7036949.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C68 H92 Co2 Gd2 N4 O22 P6 |
|---|---|
| Calculated formula | C68 H92 Co2 Gd2 N4 O22 P6 |
| SMILES | [cH]12[cH]3[cH]4[cH]5[cH]1[Co]162345[P](OCC)(OCC)O[Gd]234([N](=Cc5c(cccc5)O3)c3cc5[N]7=Cc8ccccc8O[Gd]89%107([N](=Cc7ccccc7O%10)c5cc3[N]2=Cc2ccccc2O4)O[P](OCC)(OCC)[Co]2345([cH]7[cH]2[cH]3[cH]4[cH]57)([P](OCC)(OCC)O8)[P](OCC)(OCC)O9)(O[P]1(OCC)OCC)O[P]6(OCC)OCC |
| Title of publication | Syntheses, structures, and magnetic properties of homodinuclear lanthanide complexes based on dinucleating Schiff base ligands. |
| Authors of publication | Gao, Feng; Yang, Feng-Lei; Zhu, Guang-Zhou; Zhao, Yue |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 46 |
| Pages of publication | 20232 - 20241 |
| a | 16.6338 ± 0.0008 Å |
| b | 15.3666 ± 0.0007 Å |
| c | 18.0084 ± 0.0008 Å |
| α | 90° |
| β | 104.282 ± 0.002° |
| γ | 90° |
| Cell volume | 4460.8 ± 0.4 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0518 |
| Residual factor for significantly intense reflections | 0.0395 |
| Weighted residual factors for significantly intense reflections | 0.0952 |
| Weighted residual factors for all reflections included in the refinement | 0.0978 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| 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. |
7036949.cif |
| 171108 | 2015-12-09 | cif/ Updating files of 7036943, 7036944, 7036945, 7036946, 7036947, 7036948, 7036949, 7036950, 7036951 Original log message: Adding full bibliography for 7036943--7036951.cif. |
7036949.cif |
| 169852 | 2015-10-29 | cif/ Adding structures of 7036943, 7036944, 7036945, 7036946, 7036947, 7036948, 7036949, 7036950, 7036951 via cif-deposit CGI script. |
7036949.cif |
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Users of the data should acknowledge the original authors of the
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