Information card for entry 7113079

Structure parameters

• Formula: C66 H90 F48 N16 O P8 Pd2
• Calculated formula: C66 H90 F48 N16 O P8 Pd2
• Title of publication: Directed self-assembly of a ring-in-ring complex.
• Authors of publication: Forgan, Ross S.; Friedman, Douglas C.; Stern, Charlotte L.; Bruns, Carson J.; Stoddart, J. Fraser
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 32
• Pages of publication: 5861 - 5863
• a: 8.719 ± 0.002 Å
• b: 13.919 ± 0.003 Å
• c: 22.991 ± 0.006 Å
• α: 67.791 ± 0.02°
• β: 79.998 ± 0.019°
• γ: 76.088 ± 0.019°
• Cell volume: 2496.7 ± 1.1 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: 0.1391
• Residual factor for significantly intense reflections: 0.0766
• Weighted residual factors for significantly intense reflections: 0.1801
• Weighted residual factors for all reflections included in the refinement: 0.2187
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No