Information card for entry 4505542

Structure parameters

• Formula: C104 H108 Eu4 Fe16 N16 O138
• Calculated formula: C104 H112 Eu4 Fe16 N16 O138
• Title of publication: Cation-Bonding and Protonation of the Fe4-Square Cluster
• Authors of publication: Hou, Yu; Rodriguez, Mark A.; Nyman, May
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 3
• Pages of publication: 1422
• a: 27.249 ± 0.005 Å
• b: 19.289 ± 0.004 Å
• c: 19.362 ± 0.004 Å
• α: 90°
• β: 97.799 ± 0.004°
• γ: 90°
• Cell volume: 10083 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1703
• Residual factor for significantly intense reflections: 0.1029
• Weighted residual factors for significantly intense reflections: 0.3125
• Weighted residual factors for all reflections included in the refinement: 0.3533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No