Information card for entry 7217617

Structure parameters

• Formula: C30 H26 F12 Fe N4 Pd Sb2
• Calculated formula: C30 H26 F12 Fe N4 Pd Sb2
• SMILES: [Pd]1([n]2c(c3ccc([c]45[cH]6[Fe]789%10%11%124([cH]4[cH]7[cH]8[cH]9[cH]%104)[cH]6[cH]%11[cH]5%12)c[n]13)cccc2)([n]1ccccc1)[n]1ccccc1.[Sb](F)(F)(F)(F)([F-])F.[Sb](F)(F)(F)([F-])(F)F
• Title of publication: 5-Ferrocenyl-2,2 -bipyridine Ligands: synthesis, palladium(II) and copper(I) complexes, optical and electrochemical properties.
• Authors of publication: Crowley, James D.; Scottwell, Synove O.; McAdam, C. John; Shaffer, Karl J.
• Journal of publication: RSC Advances
• Year of publication: 2014
• a: 31.201 ± 0.004 Å
• b: 11.3669 ± 0.0011 Å
• c: 19.088 ± 0.002 Å
• α: 90°
• β: 95.873 ± 0.004°
• γ: 90°
• Cell volume: 6734.2 ± 1.3 ų
• Cell temperature: 89 ± 2 K
• Ambient diffraction temperature: 89 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0866
• Residual factor for significantly intense reflections: 0.0603
• Weighted residual factors for significantly intense reflections: 0.1565
• Weighted residual factors for all reflections included in the refinement: 0.1693
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No