Information card for entry 7709931

Structure parameters

• Formula: C4 Fe N6 Sr6
• Calculated formula: C4 Fe0.999 N6 Sr6
• Title of publication: Non-Innocent Cyanido Ligands: Tetracyanidoferrate(–II) as Carbonyl Copycat
• Authors of publication: Jach, Franziska; Block, Theresa; Prots, Yurii; Schmidt, Marcus; Bobnar, Matej; Pöttgen, Rainer; Ruck, Michael; Hoehn, Peter
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 7.0212 ± 0.0002 Å
• b: 7.0212 ± 0.0002 Å
• c: 41.555 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1774.09 ± 0.11 ų
• Cell temperature: 293 ± 1 K
• Ambient diffraction temperature: 293 ± 1 K
• Number of distinct elements: 4
• Space group number: 161
• Hermann-Mauguin space group symbol: R 3 c :H
• Hall space group symbol: R 3 -2"c
• Residual factor for all reflections: 0.0536
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0669
• Goodness-of-fit parameter for significantly intense reflections: 2.67
• Goodness-of-fit parameter for all reflections included in the refinement: 2.46
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No