Information card for entry 7114678

Structure parameters

• Formula: C44 H57 B3 Cl Cu2 F12 N8 O8.5
• Calculated formula: C44 H40 B3 Cl Cu2 F12 N8 O6.5
• Title of publication: Interlinked molecular squares with [Cu(2,2′-bipy)]2+ corners generating a three-dimensional network of unprecedented topological type
• Authors of publication: Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 13
• Pages of publication: 1198
• a: 21.479 ± 0.002 Å
• b: 21.479 ± 0.002 Å
• c: 29.303 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13519 ± 2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 8
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.179
• Residual factor for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections: 0.3268
• Weighted residual factors for significantly intense reflections: 0.245
• Goodness-of-fit parameter for all reflections: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No