Information card for entry 7012375

Structure parameters

• Common name: [Fe{N(SiMe3)2}{MesNPPh2CHPPh2NMes}]
• Formula: C49 H61 Fe N3 P2 Si2
• Calculated formula: C49 H61 Fe N3 P2 Si2
• Title of publication: Tuning low-coordinate metal environments: high spin d5‒d7 complexes supported by bis(phosphinimino)methyl ligation
• Authors of publication: Evans, David J.; Hill, Michael S.; Hitchcock, Peter B.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 4
• Pages of publication: 570
• a: 11.9774 ± 0.0003 Å
• b: 18.4685 ± 0.0004 Å
• c: 21.594 ± 0.0007 Å
• α: 90°
• β: 94.42 ± 0.001°
• γ: 90°
• Cell volume: 4762.5 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0743
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No