Information card for entry 7027737

Structure parameters

• Formula: C22 H16 B F4 N5
• Calculated formula: C22 H16 B F4 N5
• Title of publication: Synthesis, characterization and crystal structures of copper(II) complexes containing multidentate polypyridine ligands †
• Authors of publication: Hemmert, Catherine; Renz, Michael; Gornitzka, Heinz; Meunier, Bernard
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 22
• Pages of publication: 3989
• a: 8.405 ± 0.001 Å
• b: 8.828 ± 0.001 Å
• c: 14.235 ± 0.002 Å
• α: 76.23 ± 0.02°
• β: 80.61 ± 0.02°
• γ: 77.32 ± 0.02°
• Cell volume: 994 ± 0.2 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0735
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1081
• Weighted residual factors for all reflections included in the refinement: 0.1218
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No