Information card for entry 7117182

Structure parameters

• Formula: C15 H29 Cu4 I4 N4
• Calculated formula: C15 H29 Cu4 I4 N4
• Title of publication: A structure-directing method to prepare semiconductive zeolitic cluster-organic frameworks with Cu3I4 building units
• Authors of publication: Yao Kang; Wei-Hui Fang; Lei Zhang; Jian Zhang
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 8994
• a: 18.5097 ± 0.0003 Å
• b: 18.5097 ± 0.0003 Å
• c: 36.1113 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12372.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 97
• Hermann-Mauguin space group symbol: I 4 2 2
• Hall space group symbol: I 4 2
• Residual factor for all reflections: 0.0553
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.1064
• Weighted residual factors for all reflections included in the refinement: 0.1136
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No