Information card for entry 4348868

Structure parameters

• Formula: C5 H13 Cl2 Fe2 N O12
• Calculated formula: C5 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: 14.914 ± 0.004 Å
• b: 23.507 ± 0.008 Å
• c: 9.261 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3247 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.1048
• Weighted residual factors for all reflections included in the refinement: 0.1144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No