Information card for entry 7717315

Structure parameters

• Formula: C56 H60 Co2 N4 O8
• Calculated formula: C56 H60 Co2 N4 O8
• Title of publication: Phase-dependent polymerization isomerism in the coordination complexes of a flexible bis(β-diketonato) ligand.
• Authors of publication: Imperato, Manuel; Nicolini, Alessio; Boniburini, Matteo; Gómez-Coca, Silvia; Ruiz, Eliseo; Santanni, Fabio; Sorace, Lorenzo; Cornia, Andrea
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 46
• Pages of publication: 18762 - 18781
• a: 8.1332 ± 0.0003 Å
• b: 12.4868 ± 0.0005 Å
• c: 14.157 ± 0.0005 Å
• α: 104.594 ± 0.0013°
• β: 92.0834 ± 0.0012°
• γ: 107.165 ± 0.0012°
• Cell volume: 1319.83 ± 0.09 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0355
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No