Information card for entry 4306003

Structure parameters

• Formula: C49.5 H46.5 Cl7.5 N8 O4
• Calculated formula: C49.5 H46.5 Cl7.5 N8 O4
• Title of publication: Inorganic Asymmetric Synthesis: Diastereoselective Syntheses of Mono- and Dinuclear Complexes Containing Octahedral, Two-Bladed Propeller, Bis(pyridine-2-aldehyde 2'-pyridylhydrazone)iron(II) Stereocenters
• Authors of publication: Rebecca J. Warr; Anthony C. Willis; S. Bruce Wild
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 9351 - 9362
• a: 30.4763 ± 0.0008 Å
• b: 16.501 ± 0.0007 Å
• c: 11.2234 ± 0.0004 Å
• α: 90°
• β: 100.813 ± 0.002°
• γ: 90°
• Cell volume: 5543.9 ± 0.3 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0728
• Residual factor for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections: 0.0823
• Weighted residual factors for significantly intense reflections: 0.0755
• Weighted residual factors for all reflections included in the refinement: 0.0755
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0675
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No