Information card for entry 7206973

Structure parameters

• Formula: C44 H46 Cu2 N4 O13
• Calculated formula: C44 H46 Cu2 N4 O13
• Title of publication: Divalent metal coordination polymers assembled from dual linkers ‒ semirigid carboxyphenylpropionate and dipyridyl type molecule
• Authors of publication: Liu, Guang-Zhen; Wang, Jian-Ge; Wang, Li-Ya
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 3
• Pages of publication: 951
• a: 16.475 ± 0.003 Å
• b: 20.866 ± 0.004 Å
• c: 12.955 ± 0.002 Å
• α: 90°
• β: 92.389 ± 0.002°
• γ: 90°
• Cell volume: 4449.6 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0562
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.0951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No