Information card for entry 2239959

Structure parameters

• Chemical name: Bis{μ-2-[(dimethylamino)methyl]ferroceneselenolato}bis[chloridopalladium(II)]
• Formula: C26 H32 Cl2 Fe2 N2 Pd2 Se2
• Calculated formula: C26 H32 Cl2 Fe2 N2 Pd2 Se2
• SMILES: [Pd]12([Se]3[Pd]([Se]1[c]14[Fe]56789%10%11([c]1([cH]7[cH]6[cH]45)C[N]2(C)C)[cH]1[cH]8[cH]9[cH]%10[cH]%111)(Cl)[N](C[c]12[Fe]456789%10([c]31[cH]4[cH]5[cH]26)[cH]1[cH]%10[cH]9[cH]8[cH]71)(C)C)Cl
• Title of publication: Crystal structure of bis{μ-2-[(dimethylamino)methyl]ferroceneselenolato}bis[chloridopalladium(II)]
• Authors of publication: Takaluoma, Esther M.; Oilunkaniemi, Raija; Laitinen, Risto S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 10
• Pages of publication: m343 - m344
• a: 13.03 ± 0.003 Å
• b: 10.985 ± 0.002 Å
• c: 19.925 ± 0.004 Å
• α: 90°
• β: 93.25 ± 0.03°
• γ: 90°
• Cell volume: 2847.4 ± 1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• 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: 0.0562
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0808
• Weighted residual factors for all reflections included in the refinement: 0.0883
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes