Information card for entry 7052373

Structure parameters

• Formula: C28 H24 Cl2 Fe N6 O8
• Calculated formula: C28 H24 Cl2 Fe N6 O8
• Title of publication: A spin-crossover iron(ii) coordination polymer with the 8-aminoquinoline ligand: synthesis, crystal structure and magnetic properties of [Fe(aqin)2(4,4?-bpy)](ClO4)2?2EtOH (aqin = 8-aminoquinoline, 4,4?-bpy = 4,4?-bipyridyl)
• Authors of publication: Genre, Caroline; Matouzenko, Galina S.; Jeanneau, Erwann; Luneau, Dominique
• Journal of publication: New Journal of Chemistry
• Year of publication: 2006
• Journal volume: 30
• Journal issue: 11
• Pages of publication: 1669
• a: 24.531 ± 0.005 Å
• b: 11.147 ± 0.005 Å
• c: 17.686 ± 0.005 Å
• α: 90°
• β: 133.306 ± 0.005°
• γ: 90°
• Cell volume: 3519 ± 2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1995
• Residual factor for significantly intense reflections: 0.1275
• Weighted residual factors for all reflections: 0.2011
• Weighted residual factors for significantly intense reflections: 0.1364
• Weighted residual factors for all reflections included in the refinement: 0.1364
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1034
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No