Information card for entry 4311826

Structure parameters

• Formula: C81 H81 Cl3 Cu3 Mn3 N15 O32
• Calculated formula: C81 H81 Cl3 Cu3 Mn3 N15 O32
• Title of publication: Ferromagnetic Coupling through Spin Polarization in the Hexanuclear [MnII3CuII3] Complex
• Authors of publication: Mirela Pascu; Francesc Lloret; Narcis Avarvari; Miguel Julve; Marius Andruh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 5189 - 5191
• a: 16.474 ± 0.002 Å
• b: 16.474 ± 0.002 Å
• c: 20.244 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4758 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 190
• Hermann-Mauguin space group symbol: P -6 2 c
• Hall space group symbol: P -6c -2c
• Residual factor for all reflections: 0.1468
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.113
• Goodness-of-fit parameter for all reflections included in the refinement: 0.808
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No