Information card for entry 4108194

Structure parameters

• Formula: C245 H218 Cl8 Cu4 F24 N20 O32 P4
• Calculated formula: C245 H218 Cl8 Cu4 F24 N20 O32 P4
• Title of publication: Cyclic [2]Pseudorotaxane Tetramers Consisting of Two Rigid Rods Threaded through Two Bis-Macrocycles: Copper(I)-Templated Synthesis and X-ray Structure Studies
• Authors of publication: Julien Frey; Christian Tock; Jean-Paul Collin; Valérie Heitz; Jean-Pierre Sauvage; Kari Rissanen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 11013 - 11022
• a: 18.4923 ± 0.0002 Å
• b: 19.6458 ± 0.0004 Å
• c: 20.4339 ± 0.0004 Å
• α: 86.311 ± 0.001°
• β: 66.573 ± 0.001°
• γ: 64.109 ± 0.001°
• Cell volume: 6074 ± 0.2 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1656
• Residual factor for significantly intense reflections: 0.1149
• Weighted residual factors for significantly intense reflections: 0.3003
• Weighted residual factors for all reflections included in the refinement: 0.3531
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No