Information card for entry 7127345

Structure parameters

• Formula: C101.5 H120 As8 Fe4 N8
• Calculated formula: C101.5 H120 As8 Fe4 N8
• Title of publication: Iron β-diiminate complexes with As₂-, As₄- and As₈-ligands.
• Authors of publication: Spitzer, Fabian; Balázs, Gábor; Graßl, Christian; Scheer, Manfred
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 86
• Pages of publication: 13209 - 13212
• a: 13.60288 ± 0.00012 Å
• b: 14.75365 ± 0.00014 Å
• c: 26.0325 ± 0.0002 Å
• α: 82.1763 ± 0.0008°
• β: 76.4461 ± 0.0008°
• γ: 78.1144 ± 0.0008°
• Cell volume: 4948.88 ± 0.08 ų
• Cell temperature: 123 ± 0.14 K
• Ambient diffraction temperature: 123 ± 0.14 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0295
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No