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Information card for entry 8102454
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Coordinates | 8102454.cif |
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Formula | C10 H24 F6 N6 O8 Si |
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Calculated formula | C10 H24 F6 N6 O8 Si |
Title of publication | Crystal structure of bis[(4R*,5R*)2-amino-4,5-trans-dihydroxy-1,3-dimethoxy-4,5-dihydroimidazolium] hexafluorosilicate, [C5H12N3O4]2[SiF6] |
Authors of publication | Alexander Schwärzler; Klaus Wurst; Gerhard Laus; Ulrich J. Griesser; Günther Bonn; Herwig Schottenberger |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2009 |
Journal volume | 224 |
Journal issue | 3 |
Pages of publication | 409 |
a | 15.646 ± 0.001 Å |
b | 15.646 ± 0.001 Å |
c | 8.2024 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2007.9 ± 0.2 Å3 |
Cell temperature | 233 ± 2 K |
Ambient diffraction temperature | 233 ± 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 | 0.0829 |
Residual factor for significantly intense reflections | 0.0519 |
Weighted residual factors for significantly intense reflections | 0.1058 |
Weighted residual factors for all reflections included in the refinement | 0.1173 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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