Information card for entry 4346101

Structure parameters

• Formula: C81 H113 N11 Nd2 O9
• Calculated formula: C81 H92 N11 Nd2 O9
• Title of publication: Lanthanide(III) di- and tetra-nuclear complexes supported by a chelating tripodal tris(amidate) ligand.
• Authors of publication: Brown, Jessie L.; Jones, Matthew B.; Gaunt, Andrew J.; Scott, Brian L.; MacBeth, Cora E.; Gordon, John C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 4064 - 4075
• a: 12.2127 ± 0.0014 Å
• b: 16.2838 ± 0.0018 Å
• c: 23.125 ± 0.003 Å
• α: 99.91 ± 0.001°
• β: 103.228 ± 0.001°
• γ: 111.062 ± 0.001°
• Cell volume: 4010.7 ± 0.8 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 120 ± 1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.062
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0873
• Weighted residual factors for all reflections included in the refinement: 0.0945
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No