Information card for entry 7042741

Structure parameters

• Formula: C54 H68 Cl3 N11 O7 Pb2
• Calculated formula: C54 H68 Cl3 N11 O7 Pb2
• Title of publication: Pb2+ Complexes of Small-Cavity Azamacrocyclic Ligands. Thermodynamic and Kinetic Studies
• Authors of publication: Liberato, Andrea; Aguinaco, Almudena; Clares, Maria Paz; Delgado-Pinar, Estefania; Blasco, Salvador; Pitarch-Jarque, Javier; Basallote, Manuel G.; García-España, Enrique; Verdejo, Begoña
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 13.1619 ± 0.0004 Å
• b: 13.0751 ± 0.0004 Å
• c: 33.1703 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5708.4 ± 0.3 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0765
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1313
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.368
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No