Information card for entry 7059817

Structure parameters

• Formula: C126 H102 Cu6 F18 N24 O6 Si3
• Calculated formula: C126 H102 Cu6 F18 N24 O6 Si3
• Title of publication: Anion-templated assembly of multinuclear copper(ii)‒triazole complexes
• Authors of publication: Gopalakrishnan, Mohan; Krittametaporn, Nuttaporn; Yoshinari, Nobuto; Konno, Takumi; Sangtrirutnugul, Preeyanuch
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 32
• Pages of publication: 13764 - 13770
• a: 23.36997 ± 0.00013 Å
• b: 23.36997 ± 0.00013 Å
• c: 23.36997 ± 0.00013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12763.6 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.07
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.4115 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No