Information card for entry 7105382

Structure parameters

• Formula: C150 H168 Cu6 N24 O48 S6
• Calculated formula: C150 H120 Cu6 N24 O48.04 S6
• Title of publication: Self-assembly of neutral hexanuclear circular copper(II) meso-helicates: topological control by sulfate ions.
• Authors of publication: Tanh Jeazet, Harold B; Gloe, Kerstin; Doert, Thomas; Kataeva, Olga N; Jäger, Anne; Geipel, Gerhard; Bernhard, Gert; Büchner, Bernd; Gloe, Karsten
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 14
• Pages of publication: 2373 - 2375
• a: 23.6595 ± 0.0002 Å
• b: 23.6595 ± 0.0002 Å
• c: 25.3773 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 12302.3 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1078
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1382
• Weighted residual factors for all reflections included in the refinement: 0.1637
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No