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Information card for entry 7122027
Preview
Coordinates | 7122027.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | [Tb(Cpttt)2][BArF20] |
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Formula | C58 H58 B F20 Tb |
Calculated formula | C58 H58 B F20 Tb |
Title of publication | Terbocenium: completing a heavy lanthanide metallocenium cation family with an alternative anion abstraction strategy. |
Authors of publication | Goodwin, Conrad A. P.; Reta, Daniel; Ortu, Fabrizio; Liu, Jingjing; Chilton, Nicholas F.; Mills, David P. |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2018 |
Journal volume | 54 |
Journal issue | 66 |
Pages of publication | 9182 - 9185 |
a | 11.7358 ± 0.0004 Å |
b | 12.4581 ± 0.0004 Å |
c | 19.971 ± 0.0009 Å |
α | 82.81 ± 0.003° |
β | 89.321 ± 0.003° |
γ | 79.728 ± 0.003° |
Cell volume | 2850.32 ± 0.19 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 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 | 0.1249 |
Residual factor for significantly intense reflections | 0.0852 |
Weighted residual factors for significantly intense reflections | 0.1912 |
Weighted residual factors for all reflections included in the refinement | 0.2105 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
228340 (current) | 2019-11-17 | cif/ Updating files of 7122025, 7122026, 7122027, 7122028, 7122029 Original log message: Adding full bibliography for 7122025--7122029.cif. |
7122027.cif |
209220 | 2018-07-24 | cif/ Adding structures of 7122025, 7122026, 7122027, 7122028, 7122029 via cif-deposit CGI script. |
7122027.cif |
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Users of the data should acknowledge the original authors of the
structural data.