Information card for entry 7010612

Structure parameters

• Formula: C33.5 H30 Cl3 Fe N5
• Calculated formula: C33.5 H30 Cl3 Fe N5
• Title of publication: Bis(imino)pyridyl iron and cobalt complexes: the effect of nitrogen substituents on ethylene oligomerisation and polymerisation
• Authors of publication: Britovsek, George J. P.; Gibson, Vernon C.; Kimberley, Brian S.; Mastroianni, Sergio; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 10
• Pages of publication: 1639
• a: 15.877 ± 0.002 Å
• b: 17.546 ± 0.003 Å
• c: 22.725 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6330.7 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0937
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for all reflections: 0.1497
• Weighted residual factors for significantly intense reflections: 0.1127
• Goodness-of-fit parameter for all reflections: 1.046
• Goodness-of-fit parameter for significantly intense reflections: 1.135
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No