Information card for entry 1564403

Structure parameters

• Formula: C52 H28 N4 O20 Pb4
• Calculated formula: C52 H28 N4 O20 Pb4
• SMILES: [Pb+2].n1c(c2ncccc2)cc(cc1C(=O)[O-])c1ccc(cc1)C(=O)[O-].[Pb+2].[O-]C(=O)c1cccc(c1)C(=O)[O-].O.O
• Title of publication: The effects of the coordination orientation and steric hindrance of ligands on the structural diversity of Pb(II) coordination polymers
• Authors of publication: Hui, Yuan-Yuan; Bai, Chao; Hu, Huai-Ming; Lv, Bei; Wang, Xiaofang
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 510
• Pages of publication: 119751
• a: 15.88 ± 0.002 Å
• b: 8.4995 ± 0.0013 Å
• c: 18.391 ± 0.003 Å
• α: 90°
• β: 91.417 ± 0.002°
• γ: 90°
• Cell volume: 2481.5 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0493
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0702
• Weighted residual factors for all reflections included in the refinement: 0.076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No