Information card for entry 7702975

Structure parameters

• Formula: C17 H16 Cl2 Cu Mn N2 O3
• Calculated formula: C17 H16 Cl2 Cu Mn N2 O3
• Title of publication: Facile synthesis of a new Cu(ii) complex with an unsymmetrical ligand and its use as an O₃ donor metalloligand in the synthesis of Cu(ii)-Mn(ii) complexes: structures, magnetic properties, and catalytic oxidase activities.
• Authors of publication: Dutta, Sabarni; Mayans, Júlia; Ghosh, Ashutosh
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 4
• Pages of publication: 1276 - 1291
• a: 7.7792 ± 0.0011 Å
• b: 13.3468 ± 0.0019 Å
• c: 18.111 ± 0.003 Å
• α: 90°
• β: 100.6 ± 0.004°
• γ: 90°
• Cell volume: 1848.3 ± 0.5 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 7
• 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: 0.0979
• Residual factor for significantly intense reflections: 0.0946
• Weighted residual factors for significantly intense reflections: 0.2711
• Weighted residual factors for all reflections included in the refinement: 0.273
• Goodness-of-fit parameter for all reflections included in the refinement: 1.139
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No