Information card for entry 4325784

Structure parameters

• Formula: C16 H16 Cu2 N4 O13
• Calculated formula: C16 H16 Cu2 N4 O13
• Title of publication: A 3D CuII Coordination Framework with μ4-/μ2-Oxalato Anions and a Bent Dipyridyl Coligand: Unique Zeolite-Type NiP2 Topological Network and Magnetic Properties
• Authors of publication: Miao Du; Zhi-Hui Zhang; Cheng-Peng Li; Jordi Ribas-Ariño; Núria Aliaga-Alcalde; Joan Ribas
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 6850 - 6852
• a: 29.81 ± 0.004 Å
• b: 9.1745 ± 0.0012 Å
• c: 8.3049 ± 0.0011 Å
• α: 90°
• β: 105.891 ± 0.002°
• γ: 90°
• Cell volume: 2184.5 ± 0.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0449
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0973
• Weighted residual factors for all reflections included in the refinement: 0.1023
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No