Information card for entry 1571612

Structure parameters

• Formula: C41 H65 I2 N2 O Y
• Calculated formula: C41 H65 I2 N2 O Y
• Title of publication: Neutral inverse-sandwich rare-earth metal complexes of the benzene tetraanion.
• Authors of publication: Wang, Yi; Zhang, Yurou; Liang, Jiefeng; Tan, Bowen; Deng, Chong; Huang, Wenliang
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 23
• Pages of publication: 8740 - 8749
• a: 12.5793 ± 0.0004 Å
• b: 21.9106 ± 0.0006 Å
• c: 15.8022 ± 0.0004 Å
• α: 90°
• β: 99.436 ± 0.003°
• γ: 90°
• Cell volume: 4296.5 ± 0.2 ų
• Cell temperature: 179.99 ± 0.1 K
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1008
• Residual factor for significantly intense reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.1789
• Weighted residual factors for all reflections included in the refinement: 0.197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No