Information card for entry 4119915

Structure parameters

• Formula: C288 H200 B6.67 Cl1.33 F26.67 N16 O16 Pd4
• Calculated formula: C288 H200 B6.6664 Cl1.3334 F26.6656 N16 O16 Pd4
• Title of publication: Template Control over Dimerization and Guest Selectivity of Interpenetrated Coordination Cages
• Authors of publication: Sabrina Freye; Reent Michel; Dietmar Stalke; Martin Pawliczek; Holm Frauendorf; Guido H. Clever
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 8476 - 8479
• a: 39.03 ± 0.002 Å
• b: 39.03 ± 0.002 Å
• c: 39.03 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 59456 ± 5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 222
• Hermann-Mauguin space group symbol: P n -3 n
• Hall space group symbol: -P 4a 2bc 3
• Residual factor for all reflections: 0.2266
• Residual factor for significantly intense reflections: 0.2212
• Weighted residual factors for significantly intense reflections: 0.5388
• Weighted residual factors for all reflections included in the refinement: 0.5471
• Goodness-of-fit parameter for all reflections included in the refinement: 5.46
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes