Information card for entry 4336674

Structure parameters

• Formula: C18 H24 Cl4 Fe N2 Sn
• Calculated formula: C18 H24 Cl4 Fe N2 Sn
• SMILES: CC1(C)CC(C)=[N]([NH+]=C(C)[c]23[cH]4[cH]5[cH]6[cH]2[Fe]27893456[cH]3[cH]2[cH]7[cH]8[cH]93)[Sn]1(Cl)(Cl)(Cl)Cl
• Title of publication: Directed Formation of a Ferrocenyl-Decorated Organotin Sulfide Complex and Its Controlled Degradation
• Authors of publication: Zhiliang You; Stefanie Dehnen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 12332 - 12334
• a: 25.781 ± 0.005 Å
• b: 10.253 ± 0.002 Å
• c: 8.2286 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2175.1 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0575
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.0934
• Weighted residual factors for all reflections included in the refinement: 0.0959
• Goodness-of-fit parameter for all reflections included in the refinement: 0.811
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No