Information card for entry 4121533

Structure parameters

• Formula: C148 H202.17 N51 O65.5 Pd8
• Calculated formula: C148 H184 N51 O65.5 Pd8
• Title of publication: Mutual induced fit in a synthetic host-guest system.
• Authors of publication: Sawada, Tomohisa; Hisada, Hayato; Fujita, Makoto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 12
• Pages of publication: 4449 - 4451
• a: 20.2126 ± 0.0014 Å
• b: 20.2126 ± 0.0014 Å
• c: 45.41 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 16067 ± 3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.2232
• Residual factor for significantly intense reflections: 0.1362
• Weighted residual factors for significantly intense reflections: 0.3402
• Weighted residual factors for all reflections included in the refinement: 0.3944
• Goodness-of-fit parameter for all reflections included in the refinement: 1.253
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No