Information card for entry 7223747

Structure parameters

• Chemical name: Nickel complex
• Formula: C43 H40 N36 Ni3 O5
• Calculated formula: C43 H40 N36 Ni3 O5
• Title of publication: Syntheses, structures, electrochemical and optical properties of four transition metal complexes based on the 1-triazolyl-3-benzimidazolyltriazene ligand
• Authors of publication: Qiu, Yan-Xuan; Miao, Yu; Wang, Zi-Zhou; Li, Zhi-Xin; Ouyang, Zhi-Jian; Yang, Liu; Lin, Wen-Ning; Feng, Wei-Jin; Dong, Wen
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 11.7945 ± 0.0011 Å
• b: 15.2176 ± 0.0014 Å
• c: 19.0428 ± 0.0018 Å
• α: 90°
• β: 105.48 ± 0.006°
• γ: 90°
• Cell volume: 3293.9 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1348
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.1772
• Weighted residual factors for all reflections included in the refinement: 0.213
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No