Information card for entry 7048543

Structure parameters

• Formula: C24 H60 Cl2 Fe K N2 O6 Si4
• Calculated formula: C24 H60 Cl2 Fe K N2 O6 Si4
• Title of publication: C-Halide bond cleavage by a two-coordinate iron(i) complex.
• Authors of publication: Werncke, C. G.; Pfeiffer, J.; Müller, I; Vendier, L.; Sabo-Etienne, S; Bontemps, S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 5
• Pages of publication: 1757 - 1765
• a: 11.9279 ± 0.0008 Å
• b: 17.7448 ± 0.0012 Å
• c: 20.9599 ± 0.0015 Å
• α: 111.463 ± 0.002°
• β: 97.733 ± 0.002°
• γ: 99.677 ± 0.002°
• Cell volume: 3975.9 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0657
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.1141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No