Information card for entry 4110292

Structure parameters

• Formula: C78 H55 I6 N17 O10 Zn3
• Calculated formula: C78 H55 I6 N17 O10 Zn3
• Title of publication: The Modular Synthesis of Functional Porous Coordination Networks
• Authors of publication: Masaki Kawano; Takehide Kawamichi; Tsuyoshi Haneda; Takahiro Kojima; Makoto Fujita
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 15418 - 15419
• a: 27.424 ± 0.003 Å
• b: 13.7934 ± 0.0014 Å
• c: 45.907 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 17365 ± 3 ų
• Cell temperature: 80 ± 2 K
• Ambient diffraction temperature: 80 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0761
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1286
• Weighted residual factors for all reflections included in the refinement: 0.1444
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No