Information card for entry 1575900

Structure parameters

• Formula: C66 H82 B N2 O3 Tb
• Calculated formula: C66 H82 B N2 O3 Tb
• Title of publication: Magnetic hysteresis in 1D organometallic lanthanide chain compounds containing 4,4'-bipyridine.
• Authors of publication: Castellanos, Ernesto; Benner, Florian; Deshapriya, Saroshan; Demir, Selvan
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 40
• Pages of publication: 18616 - 18631
• a: 17.6459 ± 0.0006 Å
• b: 21.3539 ± 0.0006 Å
• c: 17.3232 ± 0.0007 Å
• α: 90°
• β: 120.68 ± 0.005°
• γ: 90°
• Cell volume: 5613.9 ± 0.4 ų
• Cell temperature: 99.8 ± 0.9 K
• Ambient diffraction temperature: 99.8 ± 0.9 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0637
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.1412
• Goodness-of-fit parameter for all reflections included in the refinement: 1.185
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No