Information card for entry 7017334

Structure parameters

• Formula: C26 H32 B F4 N4 O Pd
• Calculated formula: C26 H32 B F4 N4 O Pd
• SMILES: [Pd]12([N](=C(c3[n]1c(ccc3)C(=O)N2CCCC)C)c1c(C(C)C)cccc1C(C)C)[N]#CC.[B](F)(F)(F)[F-]
• 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: 14.325 ± 0.003 Å
• b: 11.604 ± 0.002 Å
• c: 20.709 ± 0.007 Å
• α: 90°
• β: 125.93 ± 0.02°
• γ: 90°
• Cell volume: 2787.4 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0729
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.1323
• Weighted residual factors for all reflections included in the refinement: 0.1377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No