Information card for entry 4338280

Structure parameters

• Formula: C27 H34 Cu2 N6 O7
• Calculated formula: C27 H34 Cu2 N6 O7
• Title of publication: Enantioselective inclusion of alcohols by solvent-controlled assembled flexible metal-organic frameworks.
• Authors of publication: Lin, Lang; Yu, Rongmin; Wu, Xiao-Yuan; Yang, Wen-Bin; Zhang, Jian; Guo, Xiang-Guang; Lin, Zu-Jin; Lu, Can-Zhong
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 10
• Pages of publication: 4794 - 4796
• a: 13.041 ± 0.003 Å
• b: 14.411 ± 0.004 Å
• c: 16.307 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3064.6 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0515
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.1007
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No