Information card for entry 7110858

Structure parameters

• Formula: C258 H408 Cd6 N18 O57 S24
• Calculated formula: C258 H354 Cd6 N18 O57 S24
• Title of publication: Cadmium- and zinc-directed assembly of nano-sized, resorcarene-based host architectures which strongly bind C60
• Authors of publication: Fox, O. Danny; Wilkinson, Emma J. S.; Beer, Paul D.; Drew, Michael G. B.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 5
• Pages of publication: 391
• a: 37.517 ± 0.044 Å
• b: 37.517 ± 0.044 Å
• c: 56.042 ± 0.065 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 68313 ± 14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.2427
• Residual factor for significantly intense reflections: 0.112
• Weighted residual factors for all reflections: 0.3646
• Weighted residual factors for significantly intense reflections: 0.2956
• Goodness-of-fit parameter for all reflections: 1.001
• Goodness-of-fit parameter for significantly intense reflections: 1.282
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No