Information card for entry 7108449

Structure parameters

• Common name: Fe7abpea
• Formula: C30 H42.5 Fe N4 O8.25
• Calculated formula: C30.06 H28.9 Fe N4 O8.26
• Title of publication: A Ladder type Iron(II) Coordination Polymer with Cooperative Spin Transition
• Authors of publication: Wolfgang Bauer; Stephan Schlamp; Birgit Weber
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 10222
• a: 13.728 ± 0.0009 Å
• b: 19.597 ± 0.0013 Å
• c: 25.876 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6961.4 ± 0.7 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 23
• Hermann-Mauguin space group symbol: I 2 2 2
• Hall space group symbol: I 2 2
• Residual factor for all reflections: 0.2688
• Residual factor for significantly intense reflections: 0.0857
• Weighted residual factors for significantly intense reflections: 0.204
• Weighted residual factors for all reflections included in the refinement: 0.2841
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No