Information card for entry 2313059

Structure parameters

• Chemical name: <i>rac</i>-Dibromido[1-(dimethylaminomethyl)-2-(pyrrolidin-1-ylmethyl)\ ferrocene]cadmium(II)
• Formula: C18 H26 Br2 Cd Fe N2
• Calculated formula: C18 H26 Br2 Cd Fe N2
• Title of publication: Crystal structure and Hirshfeld surface analysis of 1-(di-methyl-amino-meth-yl)-2-(pyrrolidin-1-ylmeth-yl)ferrocene complexes with zinc(II) bromide and cadmium(II) bromide.
• Authors of publication: Moritz, Beata; Mairath, Tristan; Strohmann, Carsten
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: Pt 6
• Pages of publication: 600 - 605
• a: 9.804 ± 0.002 Å
• b: 10.502 ± 0.003 Å
• c: 20.326 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2092.8 ± 0.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0168
• Residual factor for significantly intense reflections: 0.0154
• Weighted residual factors for significantly intense reflections: 0.0311
• Weighted residual factors for all reflections included in the refinement: 0.0315
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0387
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No