Information card for entry 4511504

Structure parameters

• Formula: C34 H48 Cl2 Cu N8 O16
• Calculated formula: C32 H36 Cl2 Cu N8 O16
• Title of publication: Interplay of Hydrogen Bonds in Assembling (4,4)-Coordination Networks: Transformations from Open to Interpenetrated Networks via Anion Exchange
• Authors of publication: Sarkar, Madhushree; Biradha, Kumar
• Journal of publication: Crystal Growth & Design
• Year of publication: 2006
• Journal volume: 6
• Journal issue: 8
• Pages of publication: 1742
• a: 17.943 ± 0.003 Å
• b: 17.943 ± 0.003 Å
• c: 13.252 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3694.9 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 144
• Hermann-Mauguin space group symbol: P 31
• Hall space group symbol: P 31
• Residual factor for all reflections: 0.094
• Residual factor for significantly intense reflections: 0.0767
• Weighted residual factors for significantly intense reflections: 0.1895
• Weighted residual factors for all reflections included in the refinement: 0.2122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.288
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No