Information card for entry 8107589

Structure parameters

• Formula: C16 H20 F18 Gd2 O18
• Calculated formula: C16 H20 F18 Gd2 O18
• Title of publication: Crystal structure of tetraaqua-bis(ethanol-κO)-tetrakis(μ2-trifluoroacetate-κ2O:O′)-bis(trifluoroacetate-κ2O)digadolinium(III) Gd2C16H20O18F18
• Authors of publication: Ling, Bo-Kai; Huang, Ling-Yu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 5
• Pages of publication: 879 - 880
• a: 8.652 ± 0.003 Å
• b: 9.204 ± 0.004 Å
• c: 12.305 ± 0.005 Å
• α: 78.156 ± 0.005°
• β: 72.483 ± 0.005°
• γ: 62.797 ± 0.004°
• Cell volume: 828.4 ± 0.6 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0257
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for significantly intense reflections: 0.0539
• Weighted residual factors for all reflections included in the refinement: 0.0554
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No