Information card for entry 7034279

Structure parameters

• Formula: C300 H345 Cu12 N24 O105
• Calculated formula: C300 H345 Cu12 N24 O105
• Title of publication: Homochiral coordination cages assembled from dinuclear paddlewheel nodes and enantiopure ditopic ligands: syntheses, structures and catalysis.
• Authors of publication: Chen, Lianfen; Kang, Jian; Cui, Hao; Wang, Yingxia; Liu, Lan; Zhang, Li; Su, Cheng-Yong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 27
• Pages of publication: 12180 - 12188
• a: 17.37579 ± 0.00016 Å
• b: 18.2874 ± 0.0002 Å
• c: 32.7446 ± 0.0002 Å
• α: 77.6702 ± 0.0008°
• β: 78.5238 ± 0.0007°
• γ: 64.3532 ± 0.001°
• Cell volume: 9096.12 ± 0.16 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1183
• Weighted residual factors for all reflections included in the refinement: 0.1226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No