Information card for entry 1566568

Structure parameters

• Formula: C80 H110 Cu4 O2 P6
• Calculated formula: C80 H110 Cu4 O2 P6
• Title of publication: Cyclo-Tetrakis(μ-diphenylphosphido)-1,5-bis(tri-tert-butylphosphine)-Tetracopper
• Authors of publication: Dannenberg, Steven G.; Waterman, Rory
• Journal of publication: Molbank
• Year of publication: 2022
• Journal volume: 2022
• Journal issue: 1
• Pages of publication: M1334
• a: 17.127 ± 0.01 Å
• b: 19.946 ± 0.011 Å
• c: 23.841 ± 0.014 Å
• α: 90°
• β: 105.715 ± 0.007°
• γ: 90°
• Cell volume: 7840 ± 8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0533
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0839
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No