Information card for entry 1569016

Structure parameters

• Formula: C84 H128 Gd2 K N6 O9
• Calculated formula: C84 H128 Gd2 K N6 O9
• Title of publication: Magnetic hysteresis and large coercivity in bisbenzimidazole radical-bridged dilanthanide complexes.
• Authors of publication: Benner, Florian; La Droitte, Léo; Cador, Olivier; Le Guennic, Boris; Demir, Selvan
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 21
• Pages of publication: 5577 - 5592
• a: 13.0078 ± 0.0001 Å
• b: 18.0377 ± 0.0002 Å
• c: 18.9498 ± 0.0002 Å
• α: 81.515 ± 0.001°
• β: 81.572 ± 0.001°
• γ: 74.853 ± 0.001°
• Cell volume: 4217.51 ± 0.08 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No