Information card for entry 7133377

Structure parameters

• Formula: C62 H61 N16 O1.5
• Calculated formula: C62 H61 N16 O1.5
• Title of publication: Iron homo- and heterobimetallic complexes supported by a symmetrical dinucleating ligand.
• Authors of publication: Ríos, Pablo; See, Matthew S.; Gonzalez, Oscar; Handford, Rex C.; Nicolay, Amélie; Rao, Guodong; Britt, R. David; Bediako, D. Kwabena; Tilley, T. Don
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 67
• Pages of publication: 8912 - 8915
• a: 24.0364 ± 0.0012 Å
• b: 14.7281 ± 0.0007 Å
• c: 19.756 ± 0.0016 Å
• α: 90°
• β: 126.263 ± 0.002°
• γ: 90°
• Cell volume: 5639.2 ± 0.6 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for significantly intense reflections: 0.1511
• Weighted residual factors for all reflections included in the refinement: 0.1542
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.7288 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No