Information card for entry 7056760

Structure parameters

• Formula: C133.33 H152.98 Cu10 N16 O45.16
• Calculated formula: C133.333 H137.334 Cu10 N16 O45.1666
• Title of publication: Structure and properties of a novel staircase-like decanuclear [CuII10] cluster supported by carbonate and carboxylate bridges
• Authors of publication: Haldar, Shobhraj; Vijaykumar, Gonela; Carrella, Luca; Musie, Ghezai T.; Bera, Manindranath
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 2
• Pages of publication: 1276
• a: 12.9346 ± 0.0007 Å
• b: 16.1294 ± 0.0009 Å
• c: 18.8407 ± 0.0009 Å
• α: 86.086 ± 0.004°
• β: 84.022 ± 0.004°
• γ: 69.942 ± 0.005°
• Cell volume: 3670 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0878
• Residual factor for significantly intense reflections: 0.0716
• Weighted residual factors for significantly intense reflections: 0.1777
• Weighted residual factors for all reflections included in the refinement: 0.1855
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No