Information card for entry 7002056

Structure parameters

• Formula: C18 H24 Cl F6 N8 O2 P Pd
• Calculated formula: C18 H24 Cl F6 N8 O2 P Pd
• Title of publication: Synthesis of tetra- and pentacoordinate palladium complexes of functionalized N-heterocyclic carbenes and a comparative study of their catalytic activities
• Authors of publication: Zhang, Xiaoming; Xia, Qinqin; Chen, Wanzhi
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 35
• Pages of publication: 7045
• a: 12.0874 ± 0.0014 Å
• b: 7.4205 ± 0.0011 Å
• c: 29.316 ± 0.003 Å
• α: 90°
• β: 90.932 ± 0.002°
• γ: 90°
• Cell volume: 2629.1 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 8
• 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: 0.0692
• Residual factor for significantly intense reflections: 0.0504
• Weighted residual factors for significantly intense reflections: 0.1037
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No