Information card for entry 7046384

Structure parameters

• Formula: C50 H40 Cl4 Cu F6 N2 O P3
• Calculated formula: C49 H38 Cl2 Cu F6 N2 O P3
• Title of publication: Luminescent copper(i) complexes with bisphosphane and halogen-substituted 2,2'-bipyridine ligands.
• Authors of publication: Keller, Sarah; Prescimone, Alessandro; Bolink, Henk; Sessolo, Michele; Longo, Giulia; Martínez-Sarti, Laura; Junquera-Hernández, José M; Constable, Edwin C.; Ortí, Enrique; Housecroft, Catherine E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 40
• Pages of publication: 14263 - 14276
• a: 11.2546 ± 0.0011 Å
• b: 14.336 ± 0.0013 Å
• c: 18.0998 ± 0.0016 Å
• α: 113.273 ± 0.004°
• β: 100.571 ± 0.004°
• γ: 90.543 ± 0.004°
• Cell volume: 2626.3 ± 0.4 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1098
• Residual factor for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections: 0.2745
• Weighted residual factors for significantly intense reflections: 0.2742
• Weighted residual factors for all reflections included in the refinement: 0.2745
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9428
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No