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Information card for entry 4325100
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Coordinates | 4325100.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C12 H18 Br3 Ce N6 |
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Calculated formula | C12 H18 Br3 Ce N6 |
SMILES | [Ce](Br)(Br)(Br)([N]#CC)([N]#CC)([N]#CC)([N]#CC)[N]#CC.N#CC |
Title of publication | An Ionic Liquid-Mediated Route to Cerium(III) Bromide Solvates |
Authors of publication | Kalyan V. Vasudevan; Nickolaus A. Smith; Brian L. Scott; Edward A. McKigney; Michael W. Blair; John C. Gordon; Ross E. Muenchausen |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 4627 - 4631 |
a | 8.8 ± 0.002 Å |
b | 13.25 ± 0.003 Å |
c | 18.628 ± 0.005 Å |
α | 90° |
β | 95.13 ± 0.002° |
γ | 90° |
Cell volume | 2163.3 ± 0.9 Å3 |
Cell temperature | 140 ± 1 K |
Ambient diffraction temperature | 140 ± 1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0363 |
Residual factor for significantly intense reflections | 0.0276 |
Weighted residual factors for significantly intense reflections | 0.0961 |
Weighted residual factors for all reflections included in the refinement | 0.1053 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.206 |
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/4325100.html
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