Information card for entry 7719339

Structure parameters

• Formula: C46 H48 Gd N13 O20
• Calculated formula: C46 H48 Gd N13 O20
• Title of publication: Near-infrared emissive mononuclear lanthanide(III) complexes based on chiral Schiff base ligands: synthesis, crystal structure, luminescence, and magnetic properties.
• Authors of publication: Jeong, Yuri; Le, Ngoc Tram Anh; Ju, Jeyun; Olshevskaia, Iuliia; Cho, Daeheum; Tokunaga, Ryuya; Hayami, Shinya; Min, Kil Sik
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 38
• Pages of publication: 14533 - 14546
• a: 13.424 ± 0.004 Å
• b: 13.424 ± 0.004 Å
• c: 49.95 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7795 ± 5 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 169
• Hermann-Mauguin space group symbol: P 61
• Hall space group symbol: P 61
• Residual factor for all reflections: 0.1018
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1198
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No