Information card for entry 7118133

Structure parameters

• Formula: C118 H125 Cu4 N9 O45 S4
• Calculated formula: C118 H125 Cu4 N9 O45 S4
• Title of publication: Self-selecting homochiral quadruple-stranded helicates and control of supramolecular chirality.
• Authors of publication: Boer, Stephanie A.; Turner, David R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2015
• Journal volume: 51
• Journal issue: 98
• Pages of publication: 17375 - 17378
• a: 33.892 ± 0.004 Å
• b: 15.712 ± 0.003 Å
• c: 62.235 ± 0.008 Å
• α: 90°
• β: 104.151 ± 0.005°
• γ: 90°
• Cell volume: 32135 ± 8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1245
• Residual factor for significantly intense reflections: 0.1148
• Weighted residual factors for significantly intense reflections: 0.2806
• Weighted residual factors for all reflections included in the refinement: 0.2863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.7108 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No