Information card for entry 4512659

Structure parameters

• Formula: C30 H30 B2 Cu2 F8 N12
• Calculated formula: C30 H30 B2 Cu2 F8 N12
• Title of publication: N,N′-Dimethylene-2,2′-biimidazole—A Mimic of Carboxylate for the Formation of Complexes with Copper(I) And the Anion Directed Formation of a Solvent Pocket
• Authors of publication: Ferguson, Jayne L.; Fitchett, Christopher M.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 3
• Pages of publication: 1280
• a: 15.0798 ± 0.0006 Å
• b: 15.0798 ± 0.0006 Å
• c: 15.0798 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3429.2 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 212
• Hermann-Mauguin space group symbol: P 43 3 2
• Hall space group symbol: P 4acd 2ab 3
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0717
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No