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Information card for entry 7054827
Preview
| Coordinates | 7054827.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C59 H104 B2 N12 Yb |
|---|---|
| Calculated formula | C59 H104 B2 N12 Yb |
| Title of publication | Investigation of the “bent sandwich-like” divalent lanthanide hydro-tris(pyrazolyl)borates Ln(TpiPr2)2(Ln = Sm, Eu, Tm, Yb) |
| Authors of publication | Kühling, Marcel; Wickleder, Claudia; Ferguson, Michael J.; Hrib, Cristian G.; McDonald, Robert; Suta, Markus; Hilfert, Liane; Takats, Josef; Edelmann, Frank T. |
| Journal of publication | New J. Chem. |
| Year of publication | 2015 |
| Journal volume | 39 |
| Journal issue | 10 |
| Pages of publication | 7617 |
| a | 13.4467 ± 0.0001 Å |
| b | 20.6731 ± 0.0002 Å |
| c | 25.1841 ± 0.0002 Å |
| α | 83.205 ± 0.001° |
| β | 74.743 ± 0.001° |
| γ | 77.61 ± 0.001° |
| Cell volume | 6582.53 ± 0.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0524 |
| Residual factor for significantly intense reflections | 0.0363 |
| Weighted residual factors for significantly intense reflections | 0.064 |
| Weighted residual factors for all reflections included in the refinement | 0.0689 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
7054827.cif |
| 162113 | 2015-10-09 | cif/ Updating files of 7054827, 7054828, 7054829 Original log message: Adding full bibliography for 7054827--7054829.cif. |
7054827.cif |
| 135967 | 2015-05-09 | cif/ Adding structures of 7054827, 7054828, 7054829 via cif-deposit CGI script. |
7054827.cif |
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Users of the data should acknowledge the original authors of the
structural data.