Information card for entry 4348924

Structure parameters

• Formula: C144 H168 Cu7 N8 O16
• Calculated formula: C144 H168 Cu7 N8 O16
• Title of publication: Triple-Stranded Cluster Helicates for the Selective Catalytic Oxidation of C-H Bonds.
• Authors of publication: Fang, Yu; Gong, Wei; Liu, Lujia; Liu, Yan; Cui, Yong
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 20
• Pages of publication: 10102 - 10105
• a: 17.4508 ± 0.0006 Å
• b: 18.7149 ± 0.0006 Å
• c: 23.8379 ± 0.0008 Å
• α: 97.485 ± 0.001°
• β: 94.706 ± 0.002°
• γ: 98.437 ± 0.002°
• Cell volume: 7594.6 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0822
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.2
• Weighted residual factors for all reflections included in the refinement: 0.215
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No