Information card for entry 2210291

Structure parameters

• Chemical name: Piperazinediium μ-oxo-bis(fluorodioxochromate)
• Formula: C4 H12 Cr2 F2 N2 O5
• Calculated formula: C4 H12 Cr2 F2 N2 O5
• SMILES: C1[NH2+]CC[NH2+]C1.F[Cr](=O)([O-])O[Cr](F)(=O)[O-]
• Title of publication: Piperazinediium μ-oxo-bis(fluorodioxochromate)
• Authors of publication: Özyürek, Cengiz; Şendil, Kıvılcım; Dilek, Nefise; Ocak Iskeleli, Nazan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2263 - m2265
• a: 11.6467 ± 0.0011 Å
• b: 7.8702 ± 0.0005 Å
• c: 10.8605 ± 0.0011 Å
• α: 90°
• β: 93.452 ± 0.008°
• γ: 90°
• Cell volume: 993.69 ± 0.15 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0361
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.082
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes