Information card for entry 4325280

Structure parameters

• Formula: C48 H107 N15 Ni6 O38.5 Pr
• Calculated formula: C48 H96 N15 Ni6 O38.5 Pr
• Title of publication: Artificial Amino Acids in Nickel(II) and Nickel(II)/Lanthanide(III) Chemistry
• Authors of publication: Tereza Peristeraki; Marianna Samios; Milosz Siczek; Tadeusz Lis; Constantinos J. Milios
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 5175 - 5185
• a: 16.373 ± 0.007 Å
• b: 17.206 ± 0.008 Å
• c: 13.912 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3919 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 58
• Hermann-Mauguin space group symbol: P n n m
• Hall space group symbol: -P 2 2n
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.1008
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No