Information card for entry 4513476

Structure parameters

• Formula: C22 H18 Fe N4 O4
• Calculated formula: C22 H18 Fe N4 O4
• Title of publication: Two Series of Isostructural Coordination Polymers with Isomeric Benzenedicarboxylates and Different Azine Based N,N′-Donor Ligands: Syntheses, Characterization and Magnetic Properties
• Authors of publication: Bhattacharya, Biswajit; Maity, Dilip Kumar; Mondal, Rajarshi; Colacio, Enrique; Ghoshal, Debajyoti
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 9
• Pages of publication: 4427
• a: 7.6123 ± 0.0003 Å
• b: 13.5665 ± 0.0005 Å
• c: 19.6056 ± 0.0008 Å
• α: 90°
• β: 91.749 ± 0.002°
• γ: 90°
• Cell volume: 2023.77 ± 0.14 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0562
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No