Information card for entry 4305410

Structure parameters

• Formula: C190 H236 B2 Ir6 K2 N6 O37
• Calculated formula: C190 H236 B2 Ir6 K2 N6 O37
• Title of publication: Coordination Cages of Rhodium and Iridium as Exoreceptors for Alkali Metal Ions
• Authors of publication: Sebastian Mirtschin; Elvira Krasniqi; Rosario Scopelliti; Kay Severin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 6375 - 6381
• a: 15.287 ± 0.002 Å
• b: 15.89 ± 0.002 Å
• c: 20.76 ± 0.003 Å
• α: 107.249 ± 0.011°
• β: 99.406 ± 0.014°
• γ: 105.235 ± 0.01°
• Cell volume: 4484.5 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0707
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.1363
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No