Information card for entry 7116745

Structure parameters

• Chemical name: Chain 3
• Formula: C56 H38 Cu2 N3 O11
• Calculated formula: C56 H38 Cu2 N3 O11
• Title of publication: Multi-responsive metal-organic lantern cages in solution
• Authors of publication: Valentina Brega; Matthias Zeller; Yufan He; H. Peter Lu; Jeremy K. Klosterman
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 5077
• a: 16.1748 ± 0.0007 Å
• b: 17.1245 ± 0.0008 Å
• c: 17.3765 ± 0.0008 Å
• α: 61.699 ± 0.002°
• β: 79.187 ± 0.002°
• γ: 79.168 ± 0.002°
• Cell volume: 4135.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1415
• Residual factor for significantly intense reflections: 0.1081
• Weighted residual factors for significantly intense reflections: 0.2833
• Weighted residual factors for all reflections included in the refinement: 0.3227
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No