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Information card for entry 4509859
Preview
Coordinates | 4509859.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C2 H10 F7 N2 Ta |
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Calculated formula | C2 H10 F7 N2 Ta |
SMILES | C([NH3+])C[NH3+].[F-][Ta](F)(F)(F)(F)(F)[F-] |
Title of publication | Specific Chemistry of the Anions: [TaOF5]2‒, [TaF6]−, and [TaF7]2‒ |
Authors of publication | Lu, Hongcheng; Gautier, Romain; Donakowski, Martin D.; Fuoco, Lindsay; Liu, Zhengtang; Poeppelmeier, Kenneth R. |
Journal of publication | Crystal Growth & Design |
Year of publication | 2014 |
Journal volume | 14 |
Journal issue | 2 |
Pages of publication | 844 |
a | 9.9102 ± 0.0003 Å |
b | 7.5768 ± 0.0003 Å |
c | 11.594 ± 0.0004 Å |
α | 90° |
β | 106.918 ± 0.0018° |
γ | 90° |
Cell volume | 832.89 ± 0.05 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0167 |
Residual factor for significantly intense reflections | 0.0152 |
Weighted residual factors for significantly intense reflections | 0.0346 |
Weighted residual factors for all reflections included in the refinement | 0.0351 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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