Information card for entry 4083774

Structure parameters

• Formula: C20 H42 B Fe N5 Si2
• Calculated formula: C20 H42 B Fe N5 Si2
• Title of publication: Low-Coordinate Iron(II) Complexes of a Bulky Bis(carbene)borate Ligand
• Authors of publication: Lee, Wei-Tsung; Jeon, Ie-Rang; Xu, Song; Dickie, Diane A.; Smith, Jeremy M.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 20
• Pages of publication: 5654
• a: 15.9143 ± 0.0005 Å
• b: 14.3062 ± 0.0004 Å
• c: 11.8334 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2694.15 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0534
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.1005
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No