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Information card for entry 7030272
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Coordinates | 7030272.cif |
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Original paper (by DOI) | HTML |
Chemical name | bis(μ~2~-Fluoro)-hexafluoro-tetrakis(dimethylsulfoxide)-di-zirconium(IV) |
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Formula | C8 H24 F8 O4 S4 Zr2 |
Calculated formula | C8 H24 F8 O4 S4 Zr2 |
SMILES | F[Zr]1([O]=S(C)C)([O]=S(C)C)(F)([F][Zr](F)(F)([F]1)(F)([O]=S(C)C)[O]=S(C)C)F |
Title of publication | Preparation and structures of coordination complexes of the very hard Lewis acids ZrF4 and HfF4. |
Authors of publication | Benjamin, Sophie L.; Levason, William; Pugh, David; Reid, Gillian; Zhang, Wenjian |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2012 |
Journal volume | 41 |
Journal issue | 40 |
Pages of publication | 12548 - 12557 |
a | 16.473 ± 0.005 Å |
b | 16.473 ± 0.005 Å |
c | 7.699 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2089.2 ± 1.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 86 |
Hermann-Mauguin space group symbol | P 42/n :2 |
Hall space group symbol | -P 4bc |
Residual factor for all reflections | 0.0253 |
Residual factor for significantly intense reflections | 0.0224 |
Weighted residual factors for significantly intense reflections | 0.0526 |
Weighted residual factors for all reflections included in the refinement | 0.0538 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
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/7030272.html
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Users of the data should acknowledge the original authors of the
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