Information card for entry 7109829

Structure parameters

• Formula: C152 H138 Cl22 Cu3 N18 O58
• Calculated formula: C152 H138 Cl22 Cu3 N18 O58
• Title of publication: Reversible supra-channel effects: 3D kagome structure and catalysis via a molecular array of 1D coordination polymers
• Authors of publication: Haeri Lee; Tae Hwan Noh; Ok-Sang Jung
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 9182
• a: 38.915 ± 0.0007 Å
• b: 22.2085 ± 0.0003 Å
• c: 21.7493 ± 0.0003 Å
• α: 90°
• β: 98.683 ± 0.002°
• γ: 90°
• Cell volume: 18581.3 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.1889
• Residual factor for significantly intense reflections: 0.1148
• Weighted residual factors for significantly intense reflections: 0.3114
• Weighted residual factors for all reflections included in the refinement: 0.3728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No