Information card for entry 2243163

Structure parameters

• Chemical name: μ-Aqua-κ^2^<i>O</i>:<i>O</i>-di-μ-diphenylacetato-κ^4^<i>O</i>:<i>O</i>'-bis[(diphenylacetato-κ<i>O</i>)bis(pyridine-κ<i>N</i>)nickel(II)]
• Formula: C76 H66 N4 Ni2 O9
• Calculated formula: C76 H66 N4 Ni2 O9
• Title of publication: Crystal structures of two dimeric nickel diphenylacetate complexes
• Authors of publication: Nikiforov, A. A.; Blinou, D. O.; Dubrov, E. N.; Panina, N. S.; Ponyaev, A. I.; Gurzhiy, V. V.; Eremin, A. V.; Fischer, A. I.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 11
• Pages of publication: 1768 - 1773
• a: 13.2138 ± 0.0002 Å
• b: 14.1981 ± 0.0002 Å
• c: 17.537 ± 0.0002 Å
• α: 82.696 ± 0.001°
• β: 80.002 ± 0.001°
• γ: 80.784 ± 0.001°
• Cell volume: 3181.6 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.036
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0859
• Weighted residual factors for all reflections included in the refinement: 0.0875
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes