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Information card for entry 1564220
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Coordinates | 1564220.cif |
---|---|
Structure factors | 1564220.hkl |
Original IUCr paper | HTML |
Chemical name | Barium bis[tetrafluoridobromate(III)] |
---|---|
Formula | Ba Br2 F8 |
Calculated formula | Ba Br2 F8 |
SMILES | [Ba+2].[F-][Br](F)(F)F.[F-][Br](F)(F)F |
Title of publication | Barium bis[tetrafluoridobromate(III)] |
Authors of publication | Ivlev, Sergei I.; Kraus, Florian |
Journal of publication | IUCrData |
Year of publication | 2021 |
Journal volume | 6 |
Journal issue | 7 |
Pages of publication | x210735 |
a | 9.5823 ± 0.0006 Å |
b | 9.5823 ± 0.0006 Å |
c | 8.038 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 738.05 ± 0.12 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 3 |
Space group number | 82 |
Hermann-Mauguin space group symbol | I -4 |
Hall space group symbol | I -4 |
Residual factor for all reflections | 0.0538 |
Residual factor for significantly intense reflections | 0.0492 |
Weighted residual factors for significantly intense reflections | 0.1239 |
Weighted residual factors for all reflections included in the refinement | 0.1268 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54186 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
267671 (current) | 2021-07-21 | cif/ hkl/ Adding structures of 1564220 via cif-deposit CGI script. |
1564220.cif 1564220.hkl |
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Users of the data should acknowledge the original authors of the
structural data.