Information card for entry 1577087

Structure parameters

• Formula: C48.866 H72.693 La2 N8 O30
• Calculated formula: C48.866 H72.694 La2 N8 O30
• Title of publication: Picolinate-based acyclic ligand for rare earth element extraction and separation
• Authors of publication: Gao, Yangyang; Medin, Sean; Schmitz, Alexa M.; Wilson, Justin J.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 20.903 ± 0.003 Å
• b: 8.2203 ± 0.001 Å
• c: 17.5505 ± 0.0019 Å
• α: 90°
• β: 105.955 ± 0.008°
• γ: 90°
• Cell volume: 2899.5 ± 0.6 ų
• Cell temperature: 100.04 K
• Ambient diffraction temperature: 100.04 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0625
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0723
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0195
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No