Information card for entry 4336241

Structure parameters

• Formula: C27 H23 Cl4 Fe2 N3 Sn2
• Calculated formula: C27 H23 Cl4 Fe2 N3 Sn2
• SMILES: [Sn]12(Cl)[N](=Cc3[n]1c(C=[N]2[c]12[Fe]456789%10([cH]1[cH]4[cH]5[cH]26)[cH]1[cH]7[cH]8[cH]9[cH]%101)ccc3)[c]12[Fe]3456789([cH]1[cH]3[cH]4[cH]25)[cH]1[cH]6[cH]7[cH]8[cH]91.[Sn](Cl)(Cl)[Cl-]
• Title of publication: A Novel Diiminopyridine Ligand Containing Redox Active Co(III) Mixed Sandwich Complexes
• Authors of publication: Eleanor Magdzinski; Pierangelo Gobbo; Mark S. Workentin; Paul J. Ragogna
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 11311 - 11319
• a: 13.383 ± 0.005 Å
• b: 7.448 ± 0.003 Å
• c: 29.974 ± 0.011 Å
• α: 90°
• β: 96.22 ± 0.004°
• γ: 90°
• Cell volume: 2970 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.0629
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No