Information card for entry 4348870

Structure parameters

• Formula: C5 H13 Cl2 Fe2 N O12
• Calculated formula: C5 H13 Cl2 Fe2 N O12
• Title of publication: Selective Guest Inclusion in Oxalate-Based Iron(III) Magnetic Coordination Polymers.
• Authors of publication: Mastropietro, Teresa F.; Marino, Nadia; Munno, Giovanni De; Lloret, Francesc; Julve, Miguel; Pardo, Emilio; Armentano, Donatella
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 21
• Pages of publication: 11160 - 11169
• a: 8.945 ± 0.003 Å
• b: 14.936 ± 0.005 Å
• c: 12.408 ± 0.005 Å
• α: 90°
• β: 108.531 ± 0.008°
• γ: 90°
• Cell volume: 1571.8 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0572
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1557
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No