Information card for entry 2108985

Structure parameters

• Formula: C22 H32 Cu N2 O12
• Calculated formula: C22 H32 Cu N2 O12
• Title of publication: Synthesis, structural and electrochemical properties of a new family of amino-acid-based coordination complexes
• Authors of publication: Rey, Juan Manuel; Movilla, Federico; Suárez, Sebastián Angel; Di Salvo, Florencia
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2022
• Journal volume: 78
• Journal issue: 3 Part 2
• a: 13.9887 ± 0.0007 Å
• b: 6.891 ± 0.0002 Å
• c: 14.3405 ± 0.0007 Å
• α: 90°
• β: 109.51 ± 0.005°
• γ: 90°
• Cell volume: 1303 ± 0.11 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298.15 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0448
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0882
• Weighted residual factors for all reflections included in the refinement: 0.0939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes