Information card for entry 7018734

Structure parameters

• Formula: C66 H58 Cd3 N4 O16
• Calculated formula: C66 H54 Cd3 N4 O16
• Title of publication: A twelve-connected porous framework built from rare linear cadmium tricarboxylate pentamer.
• Authors of publication: Lin, Qipu; Wu, Tao; Bu, Xianhui; Feng, Pingyun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 13
• Pages of publication: 3620 - 3622
• a: 10.0514 ± 0.0006 Å
• b: 14.6745 ± 0.0008 Å
• c: 14.8435 ± 0.0008 Å
• α: 69.202 ± 0.003°
• β: 83.2 ± 0.004°
• γ: 88.432 ± 0.004°
• Cell volume: 2032.1 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0891
• Residual factor for significantly intense reflections: 0.0565
• Weighted residual factors for significantly intense reflections: 0.1318
• Weighted residual factors for all reflections included in the refinement: 0.1455
• Goodness-of-fit parameter for all reflections included in the refinement: 0.955
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No