Information card for entry 4121509

Structure parameters

• Formula: C40 H31 F12 N11 O12 Pb2 S4
• Calculated formula: C40 H31 F12 N11 O12 Pb2 S4
• Title of publication: Coupled Nanomechanical Motions: Metal-Ion-Effected, pH-Modulated, Simultaneous Extension/Contraction Motions of Double-Domain Helical/Linear Molecular Strands.
• Authors of publication: Stadler, Adrian-Mihail; Lehn, Jean-Marie P
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 9
• Pages of publication: 3400 - 3409
• a: 11.7399 ± 0.0007 Å
• b: 15.2644 ± 0.0009 Å
• c: 16.1523 ± 0.001 Å
• α: 92.087 ± 0.001°
• β: 108.693 ± 0.001°
• γ: 104.202 ± 0.001°
• Cell volume: 2637.1 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0706
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1131
• Weighted residual factors for all reflections included in the refinement: 0.1253
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No