Information card for entry 1569298

Structure parameters

• Formula: C50 H63.61 Ce Cl N2 O2
• Calculated formula: C50 H63.61 Ce Cl N2 O2
• Title of publication: Synthesis and comparison of iso-structural f-block metal complexes (Ce, U, Np, Pu) featuring <i>η</i>⁶-arene interactions.
• Authors of publication: Murillo, Jesse; Goodwin, Conrad A. P.; Stevens, Lauren; Fortier, Skye; Gaunt, Andrew J.; Scott, Brian L.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 27
• Pages of publication: 7438 - 7446
• a: 10.5933 ± 0.0002 Å
• b: 13.7861 ± 0.0004 Å
• c: 16.9187 ± 0.0004 Å
• α: 78.826 ± 0.001°
• β: 73.728 ± 0.001°
• γ: 69.733 ± 0.001°
• Cell volume: 2212.12 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0477
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0714
• Weighted residual factors for all reflections included in the refinement: 0.0783
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No