Information card for entry 7017331

Structure parameters

• Formula: C26 H36 Cl N3 O Pd
• Calculated formula: C26 H36 Cl N3 O Pd
• SMILES: [Pd]12([N](=C(c3[n]1c(C(=O)N2CCCCCCCC)ccc3)C)c1c(cccc1CC)CC)Cl
• 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: 31.28 ± 0.004 Å
• b: 31.28 ± 0.004 Å
• c: 14.424 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 12222 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 161
• Hermann-Mauguin space group symbol: R 3 c :H
• Hall space group symbol: R 3 -2"c
• Residual factor for all reflections: 0.0462
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.0941
• Goodness-of-fit parameter for all reflections included in the refinement: 0.894
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No