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Information card for entry 4120018
Preview
Coordinates | 4120018.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H39 Pr Si3 |
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Calculated formula | C24 H39 Pr Si3 |
SMILES | [Pr]123456789%10%11%12([cH]%13[cH]1[cH]2[cH]3[c]4%13[Si](C)(C)C)([cH]1[cH]5[cH]6[cH]7[c]81[Si](C)(C)C)[cH]1[cH]9[cH]%10[cH]%11[c]%121[Si](C)(C)C |
Title of publication | Completing the Series of +2 Ions for the Lanthanide Elements: Synthesis of Molecular Complexes of Pr2+, Gd2+, Tb2+, and Lu2+ |
Authors of publication | Matthew R. MacDonald; Jefferson E. Bates; Joseph W. Ziller; Filipp Furche; William J. Evans |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2013 |
Journal volume | 135 |
Pages of publication | 9857 - 9868 |
a | 8.3212 ± 0.0003 Å |
b | 22.1167 ± 0.0008 Å |
c | 29.02 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5340.8 ± 0.3 Å3 |
Cell temperature | 88 ± 2 K |
Ambient diffraction temperature | 88 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0213 |
Residual factor for significantly intense reflections | 0.0161 |
Weighted residual factors for significantly intense reflections | 0.0366 |
Weighted residual factors for all reflections included in the refinement | 0.0387 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4120018.html
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