Information card for entry 2201241

Structure parameters

• Formula: C30 H24 Cl8 Fe3 N6
• Calculated formula: C30 H24 Cl8 Fe3 N6
• SMILES: [Fe]123([n]4ccccc4c4[n]1cccc4)([n]1ccccc1c1[n]2cccc1)[n]1ccccc1c1[n]3cccc1.[Fe](Cl)(Cl)(Cl)[Cl-].[Fe](Cl)(Cl)(Cl)[Cl-]
• Title of publication: Tris(2,2'-bipyridyl-<i>N,N</i>')iron(II) bis[tetrachloroferrate(III)]
• Authors of publication: L. Mihiri D. Ariyananda; Richard E. Norman
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 12
• Pages of publication: m775 - m776
• a: 18.6108 ± 0.0004 Å
• b: 10.7729 ± 0.0002 Å
• c: 18.5661 ± 0.0006 Å
• α: 90°
• β: 100.381 ± 0.002°
• γ: 90°
• Cell volume: 3661.43 ± 0.16 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0555
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for all reflections: 0.0856
• Weighted residual factors for all reflections included in the refinement: 0.0717
• Goodness-of-fit parameter for all reflections: 0.916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes