Information card for entry 7214671

Structure parameters

• Formula: C72 H78 Br12 Cu12 N12 O39 Tb4
• Calculated formula: C72 H48 Br12 Cu12 N12 O39 Tb4
• Title of publication: A series of 3d‒4f heterometallic coordination polymers constructed from size-tunable copper halide clusters and lanthanide-organic motifs
• Authors of publication: Peng, Guo; Liu, Zhihui; Ma, Li; Liang, Li; Zhang, Limin; Kostakis, George. E; Deng, Hong
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 18
• Pages of publication: 5974
• a: 9.8116 ± 0.0007 Å
• b: 14.7661 ± 0.001 Å
• c: 20.1753 ± 0.0014 Å
• α: 73.213 ± 0.001°
• β: 82.541 ± 0.001°
• γ: 77.748 ± 0.001°
• Cell volume: 2727.3 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.048
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0789
• Weighted residual factors for all reflections included in the refinement: 0.0848
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No