Information card for entry 2205940

Structure parameters

• Chemical name: Bis(μ-2,6-diformyl-4-methylphenolato)bis[bis(2,6-diformyl-4- methylphenolato)neodymium(III)]
• Formula: C54 H42 Nd2 O18
• Calculated formula: C54 H42 Nd2 O18
• Title of publication: Bis(μ-2,6-diformyl-4-methylphenolato)bis[bis(2,6-diformyl-4-methylphenolato)neodymium(III)]
• Authors of publication: Singh-Wilmot, Marvadeen A.; Kahwa, Ishenkumba A.; Lough, Alan J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 6
• Pages of publication: m1009 - m1011
• a: 21.1211 ± 0.0006 Å
• b: 15.0486 ± 0.0004 Å
• c: 15.5611 ± 0.0005 Å
• α: 90°
• β: 97.181 ± 0.001°
• γ: 90°
• Cell volume: 4907.2 ± 0.2 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 4
• 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: 0.0625
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes