Information card for entry 7008650

Structure parameters

• Formula: C20 H16 Co F6 N6 O2 P
• Calculated formula: C20 H16 Co F6 N6 O2 P
• Title of publication: Novel organometallic building blocks for molecular crystal engineering. Part 4. Synthesis and characterization of mono- and bis-amido derivatives of [Co(III)(eta5-C5H4COOH)2]+ and their utilization as ligands.
• Authors of publication: Braga, Dario; Polito, Marco; Giaffreda, Stefano L.; Grepioni, Fabrizia
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 16
• Pages of publication: 2766 - 2773
• a: 8.2145 ± 0.0002 Å
• b: 10.0998 ± 0.0003 Å
• c: 25.618 ± 0.0007 Å
• α: 90°
• β: 98.322 ± 0.001°
• γ: 90°
• Cell volume: 2103.01 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1288
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.1548
• Weighted residual factors for all reflections included in the refinement: 0.194
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No