Information card for entry 4326479

Structure parameters

• Common name: [Ni(pyN2iPr2)(OH)] (Et4N) CH3COOC2H5
• Formula: C43 H66 N4 Ni O5
• Calculated formula: C43 H66 N4 Ni O5
• Title of publication: Fast Carbon Dioxide Fixation by 2,6-Pyridinedicarboxamidato-nickel(II)-hydroxide Complexes: Influence of Changes in Reactive Site Environment on Reaction Rates
• Authors of publication: Deguang Huang; Olga V. Makhlynets; Lay Ling Tan; Sonny C. Lee; Elena V. Rybak-Akimova; R. H. Holm
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 10070 - 10081
• a: 14.8167 ± 0.0015 Å
• b: 14.4241 ± 0.0015 Å
• c: 19.689 ± 0.002 Å
• α: 90°
• β: 93.352 ± 0.002°
• γ: 90°
• Cell volume: 4200.7 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.1185
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No