Information card for entry 2212134

Structure parameters

• Chemical name: cis-Bis(2,2'-bipyridine)difluorochromium(III) perchlorate
• Formula: C20 H16 Cl Cr F2 N4 O4
• Calculated formula: C20 H16 Cl Cr F2 N4 O4
• SMILES: c1cccc2c3cccc[n]3[Cr]3(F)(F)([n]12)[n]1ccccc1c1cccc[n]31.Cl(=O)(=O)(=O)[O-]
• Title of publication: <i>cis</i>-Bis(2,2'-bipyridine)difluorochromium(III) perchlorate
• Authors of publication: Yamaguchi-Terasaki, Yukiko; Fujihara, Takashi; Nagasawa, Akira; Kaizaki, Sumio
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: m593 - m595
• a: 8.0017 ± 0.0004 Å
• b: 9.4888 ± 0.0004 Å
• c: 13.6101 ± 0.0006 Å
• α: 95.71 ± 0.001°
• β: 100.762 ± 0.0008°
• γ: 93.253 ± 0.0009°
• Cell volume: 1007.15 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.0915
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes