Information card for entry 4338758

Structure parameters

• Formula: C48 H62 Ce2 Mn4 N14 O31
• Calculated formula: C36 H42 Ce2 Mn4 N8 O30.764
• Title of publication: Manganese/Cerium Clusters Spanning a Range of Oxidation Levels and CeMn8, Ce2Mn4, and Ce6Mn4 Nuclearities: Structural, Magnetic, and EPR Properties.
• Authors of publication: Lampropoulos, Christos; Thuijs, Annaliese E.; Mitchell, Kylie J.; Abboud, Khalil A.; Christou, George
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 13
• Pages of publication: 6805 - 6816
• a: 11.5998 ± 0.0009 Å
• b: 12.075 ± 0.0009 Å
• c: 13.1809 ± 0.001 Å
• α: 108.886 ± 0.001°
• β: 104.727 ± 0.001°
• γ: 90.137 ± 0.001°
• Cell volume: 1682.2 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0371
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.1009
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No