Information card for entry 4348887

Structure parameters

• Formula: C150 H182 Cl2 Mn19 N4 O80
• Calculated formula: C150 H140 Cl2 Mn19 N4 O60
• Title of publication: Syntheses, structures and magnetism of mixed-valence Mn19 and Mn21 complexes supported by alkylamine-based alkoxo-bridging ligands
• Authors of publication: Ida, Hiromichi; Shiga, Takuya; Newton, Graham N.; Oshio, Hiroki
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2015
• Journal volume: 2
• Journal issue: 6
• Pages of publication: 538
• a: 35.738 ± 0.007 Å
• b: 19.551 ± 0.004 Å
• c: 25.253 ± 0.005 Å
• α: 90°
• β: 99.033 ± 0.003°
• γ: 90°
• Cell volume: 17426 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1566
• Residual factor for significantly intense reflections: 0.076
• Weighted residual factors for significantly intense reflections: 0.1705
• Weighted residual factors for all reflections included in the refinement: 0.1975
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No