Information card for entry 7719892

Structure parameters

• Formula: C27 H29 N3 Ni O2
• Calculated formula: C27 H29 N3 Ni O2
• Title of publication: Defining the oxidation site in Cu(II) and Ni(II) Complexes of ligands combining amido, phenolato and pyridine donors
• Authors of publication: Wang, Guanqi; Philouze, Christian; Berthiol, Florian; Moreau, Yohann; Jarjayes, Olivier; Thomas, Fabrice
• Journal of publication: Dalton Transactions
• Year of publication: 2025
• a: 9.993 ± 0.002 Å
• b: 17.902 ± 0.004 Å
• c: 13.521 ± 0.003 Å
• α: 90°
• β: 106.93 ± 0.03°
• γ: 90°
• Cell volume: 2314 ± 0.9 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0436
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0785
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No