Information card for entry 7012370

Structure parameters

• Formula: C30.5 H24 Cl Fe N4 O0.5
• Calculated formula: C30.5 H23 Cl Fe N4 O0.5
• Title of publication: Synthetic, spectroscopic and olefin oligomerisation studies on nickel and palladium complexes containing ferrocene substituted nitrogen donor ligands
• Authors of publication: Gibson, Vernon C.; Halliwell, Catherine M.; Long, Nicholas J.; Oxford, Philip J.; Smith, Andrew M.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 5
• Pages of publication: 918
• a: 10.98 ± 0.0015 Å
• b: 13.481 ± 0.0014 Å
• c: 18.574 ± 0.002 Å
• α: 100.235 ± 0.008°
• β: 96.55 ± 0.01°
• γ: 108.479 ± 0.011°
• Cell volume: 2523 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1099
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for all reflections: 0.1757
• Weighted residual factors for significantly intense reflections: 0.1409
• Goodness-of-fit parameter for all reflections: 1.013
• Goodness-of-fit parameter for significantly intense reflections: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No