Information card for entry 8107222

Structure parameters

• Formula: C52 H36 Er2 N6 O14
• Calculated formula: C52 H36 Er2 N6 O14
• Title of publication: Crystal structure of bis(μ2-benzoato-k2O:O′)-bis(μ2-benzoato-k3O,O′:O′)dinitrato-k2O,O′-bis(phenanthroline-k2 N,N′)dierbium(III), C52H36Er2N6O14
• Authors of publication: Li, Zhang; Hai-yan, Yu; Ying-lei, Wang; Ru-lin, Li; Ying-han, Cao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2022
• Journal volume: 237
• Journal issue: 5
• Pages of publication: 807 - 809
• a: 10.6499 ± 0.0005 Å
• b: 11.0111 ± 0.0005 Å
• c: 11.038 ± 0.0006 Å
• α: 85.03 ± 0.004°
• β: 81.502 ± 0.004°
• γ: 68.925 ± 0.004°
• Cell volume: 1193.77 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0316
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0592
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No