Information card for entry 7046938

Structure parameters

• Formula: C78 H76 N12 Ni3 O26
• Calculated formula: C78 H76 N12 Ni3 O26
• Title of publication: Polycarboxylate-directed semi-rigid pyridyl-amide-based various Ni^II complexes: electrochemical properties and enhancements of photocatalytic activities by calcination.
• Authors of publication: Wang, Xiuli; Xiong, Ying; Liu, Guocheng; Lin, Hongyan; Wang, Xiang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 29
• Pages of publication: 9903 - 9911
• a: 10.1922 ± 0.0006 Å
• b: 10.6522 ± 0.0006 Å
• c: 17.2595 ± 0.001 Å
• α: 84.583 ± 0.001°
• β: 87.635 ± 0.001°
• γ: 80.777 ± 0.001°
• Cell volume: 1840.72 ± 0.18 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0692
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No