Information card for entry 7102047

Structure parameters

• Formula: C60 H48 B Cu F4 P4
• Calculated formula: C60 H48 B Cu F4 P4
• Title of publication: Electrophosphorescent homo- and heteroleptic copper(I) complexes prepared from various bis-phosphine ligands.
• Authors of publication: Moudam, Omar; Kaeser, Adrien; Delavaux-Nicot, Béatrice; Duhayon, Carine; Holler, Michel; Accorsi, Gianluca; Armaroli, Nicola; Séguy, Isabelle; Navarro, Jose; Destruel, Pierre; Nierengarten, Jean-François
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 29
• Pages of publication: 3077 - 3079
• a: 13.5721 ± 0.0009 Å
• b: 12.5841 ± 0.0008 Å
• c: 14.9692 ± 0.0012 Å
• α: 90°
• β: 100.516 ± 0.006°
• γ: 90°
• Cell volume: 2513.7 ± 0.3 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0798
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for all reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.0579
• Weighted residual factors for all reflections included in the refinement: 0.0579
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1501
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No