Information card for entry 7212604

Structure parameters

• Formula: C38 H34 Cu3 N6 O23
• Calculated formula: C38 H30 Cu3 N6 O23
• Title of publication: The roles of the coordination modes of bridging ligands for the formation of two 3D metal‒organic coordination networks
• Authors of publication: Yan, Si-Tang; Shi, Lian-Xu; Sun, Fei-Fei; Wu, Chuan-De
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 11
• Pages of publication: 3437
• a: 12.2892 ± 0.0015 Å
• b: 11.0889 ± 0.0014 Å
• c: 16.49 ± 0.002 Å
• α: 90°
• β: 110.129 ± 0.014°
• γ: 90°
• Cell volume: 2109.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.119
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.0788
• Weighted residual factors for all reflections included in the refinement: 0.0851
• Goodness-of-fit parameter for all reflections included in the refinement: 0.912
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No