Information card for entry 7017332

Structure parameters

• Formula: C24 H33 Cl2 N3 Ni O
• Calculated formula: C24 H33 Cl2 N3 Ni O
• SMILES: [Ni]12(Cl)(Cl)[n]3c(cccc3C(=[N]2c2c(C(C)C)cccc2C(C)C)C)C(=[O]1)NCCCC
• Title of publication: 2-(N-Alkylcarboxamide)-6-iminopyridyl palladium and nickel complexes: coordination chemistry and catalysis.
• Authors of publication: Zhang, Wenjuan; Wang, Youhong; Yu, Jiangang; Redshaw, Carl; Hao, Xiang; Sun, Wen-Hua
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 48
• Pages of publication: 12856 - 12865
• a: 10.797 ± 0.002 Å
• b: 16.923 ± 0.003 Å
• c: 13.86 ± 0.003 Å
• α: 90°
• β: 92.19 ± 0.03°
• γ: 90°
• Cell volume: 2530.6 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.1328
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1514
• Weighted residual factors for all reflections included in the refinement: 0.1743
• Goodness-of-fit parameter for all reflections included in the refinement: 0.913
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No