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Information card for entry 7233573
Preview
Coordinates | 7233573.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H78 Cd Cl5 Gd N24 O25 |
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Calculated formula | C44 H52 Cd Cl5 Gd N24 O25 |
Title of publication | The lanthanide contraction effect and organic additives impact the coordination structures of lanthanide ions with symmetrical octamethyl-substituted cucurbit[6]uril ligands |
Authors of publication | Lin, Rui-Lian; Zhou, Jia-Jia; Zhou, Fu Hou; Sun, Wen-Qi; Liu, Jing-Xin; Chen, Kai |
Journal of publication | CrystEngComm |
Year of publication | 2019 |
Journal volume | 21 |
Journal issue | 37 |
Pages of publication | 5641 |
a | 12.3443 ± 0.0015 Å |
b | 15.456 ± 0.0019 Å |
c | 18.558 ± 0.002 Å |
α | 81.136 ± 0.002° |
β | 87.379 ± 0.002° |
γ | 87.409 ± 0.002° |
Cell volume | 3492.2 ± 0.7 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.055 |
Residual factor for significantly intense reflections | 0.0468 |
Weighted residual factors for significantly intense reflections | 0.1345 |
Weighted residual factors for all reflections included in the refinement | 0.1432 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7233573.html
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Users of the data should acknowledge the original authors of the
structural data.