Information card for entry 8105803

Structure parameters

• Formula: C32 H26 N6 Ni O4
• Calculated formula: C32 H26 N6 Ni O4
• Title of publication: Crystal structure of (4,4′-(ethane-1,2-diylbis((nitrilo)(2-furylmethylylidene)))bis(3-methyl-1-phenyl-1H-pyrazol-5-olato-κ4 N,N′,O,O′))-nickel(II)), C32H26N6NiO4
• Authors of publication: Wei, Wei; Wu, Qiong; Zhang, Heng-Qiang; Jin, Tong-Yin; Chen, Hong-Li
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 4
• Pages of publication: 633 - 634
• a: 22.27 ± 0.004 Å
• b: 13.648 ± 0.002 Å
• c: 10.006 ± 0.002 Å
• α: 90°
• β: 111.222 ± 0.003°
• γ: 90°
• Cell volume: 2835 ± 0.9 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• 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: 0.0666
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No