Information card for entry 8105226

Structure parameters

• Formula: C28 H26 N8 Ni O2
• Calculated formula: C28 H26 N8 Ni O2
• Title of publication: Crystal structure of bis(3-methyl-N-(1-(pyrazin-2-yl)ethylidene)benzohydrazonato-κ3 O,N,N′)nickel(II), C28H26N8O2Ni
• Authors of publication: Yang, Xue-Mei; Zhu, Tao; Lin, Long
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 3
• Pages of publication: 585 - 586
• a: 11.813 ± 0.01 Å
• b: 21.433 ± 0.017 Å
• c: 10.03 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2539 ± 4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 41
• Hermann-Mauguin space group symbol: A e a 2
• Hall space group symbol: A 2 -2ab
• Residual factor for all reflections: 0.0904
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.0838
• Weighted residual factors for all reflections included in the refinement: 0.0992
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No