Information card for entry 7102584

Structure parameters

• Formula: C69.13 H57.38 Cu3 N15 Na0.13 O13 S
• Calculated formula: C69.38 H54.78 Cu3 N15 Na0.125 O13.01 S
• Title of publication: Solid state characterization of oligopyridine dicarboxamide helicates.
• Authors of publication: Maurizot, Victor; Linti, Gerald; Huc, Ivan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2004
• Journal issue: 8
• Pages of publication: 924 - 925
• a: 32.177 ± 0.006 Å
• b: 15.395 ± 0.003 Å
• c: 29.607 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14666 ± 5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1095
• Residual factor for significantly intense reflections: 0.0672
• Weighted residual factors for significantly intense reflections: 0.1857
• Weighted residual factors for all reflections included in the refinement: 0.2067
• Goodness-of-fit parameter for all reflections included in the refinement: 0.942
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No