Information card for entry 4339671

Structure parameters

• Formula: C31 H46.5 Ce3 Mn2 N6.5 O34.5
• Calculated formula: C36 H43.5 Ce3 Mn2 N3.5 O34.5
• Title of publication: Mixed transition metal-lanthanide complexes at high oxidation states: heteronuclear CeIVMnIV clusters.
• Authors of publication: Tasiopoulos, Anastasios J.; Milligan, Jr, Paul L; Abboud, Khalil A.; O'Brien, Ted A; Christou, George
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 23
• Pages of publication: 9678 - 9691
• a: 18.4824 ± 0.001 Å
• b: 15.44 ± 0.0008 Å
• c: 18.8592 ± 0.001 Å
• α: 90°
• β: 104.376 ± 0.001°
• γ: 90°
• Cell volume: 5213.3 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0857
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1256
• Weighted residual factors for all reflections included in the refinement: 0.1361
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No