Information card for entry 7711459

Structure parameters

• Formula: C115.43 H90.72 Cr4 Cu6 N18 O61.36
• Calculated formula: C115.44 H91.44 Cr4 Cu6 N18 O61.44
• Title of publication: Oxalate-based [CuIICrIII] coordination compounds affected by the tridentate ligand, simple anion, and reactant ratio: structural and magnetic features
• Authors of publication: Molčanov, Lidija; Šenjug, Pavla; Barišić, Dario; Pajić, Damir; Molčanov, Krešimir; Jurić, Marijana
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 13.8968 ± 0.0003 Å
• b: 14.6704 ± 0.0002 Å
• c: 17.5201 ± 0.0003 Å
• α: 102.093 ± 0.002°
• β: 102.941 ± 0.002°
• γ: 107.378 ± 0.002°
• Cell volume: 3172.17 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for all reflections included in the refinement: 0.1243
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No