Information card for entry 7232376

Structure parameters

• Formula: C32.9 H41 Br0.1 F8.7 N3 O21.7 S2.9 Yb
• Calculated formula: C32.9 H31 Br0.1 F8.7 N3 O16.7 S2.9 Yb
• Title of publication: In-depth structural analysis of lanthanoid coordination networks based on a flexible tripodal zwitterionic isonicotinate ligand
• Authors of publication: Tiihonen, Antti; Lahtinen, Manu
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 14
• Pages of publication: 2286
• a: 10.0256 ± 0.0003 Å
• b: 14.2571 ± 0.0004 Å
• c: 18.5311 ± 0.0005 Å
• α: 109.018 ± 0.003°
• β: 105.086 ± 0.003°
• γ: 95.287 ± 0.002°
• Cell volume: 2372.01 ± 0.14 ų
• Cell temperature: 120.01 ± 0.1 K
• Ambient diffraction temperature: 120.01 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0913
• Residual factor for significantly intense reflections: 0.0822
• Weighted residual factors for significantly intense reflections: 0.2401
• Weighted residual factors for all reflections included in the refinement: 0.2745
• Goodness-of-fit parameter for all reflections included in the refinement: 1.184
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No