Information card for entry 4079816

Structure parameters

• Formula: C46.88 H53.75 Cl1.75 F12 N6 Ni O2 P2 Pd
• Calculated formula: C46.875 H53.75 Cl1.75 F12 N6 Ni O2 P2 Pd
• Title of publication: Homo- and Heterobimetallic Pd‒, Ag‒, and Ni‒Hybrid Salen‒Bis-NHC Complexes
• Authors of publication: Mechler, Melanie; Latendorf, Katja; Frey, Wolfgang; Peters, René
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 1
• Pages of publication: 112
• a: 61.674 ± 0.004 Å
• b: 12.8551 ± 0.001 Å
• c: 13.3812 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10609 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0961
• Residual factor for significantly intense reflections: 0.0932
• Weighted residual factors for significantly intense reflections: 0.2229
• Weighted residual factors for all reflections included in the refinement: 0.2253
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No