Information card for entry 7032850

Structure parameters

• Formula: C27.5 H35.5 N14.5 O11.5 Pb2
• Calculated formula: C20 H18 N12 O9 Pb2
• SMILES: [Pb]12([O]3[Pb]4(OC(=O)c5[n]4ccnc5N)([O]1C(=O)c1nccnc1N)[n]1c(C3=O)c(N)ncc1)OC(=O)c1[n]2ccnc1N.O
• Title of publication: Synthesis, structure and catalytic application of lead(II) complexes in cyanosilylation reactions.
• Authors of publication: Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M Fátima C; Pombeiro, Armando J. L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 1
• Pages of publication: 268 - 280
• a: 14.468 ± 0.003 Å
• b: 13.261 ± 0.002 Å
• c: 19.861 ± 0.004 Å
• α: 90°
• β: 90.964 ± 0.007°
• γ: 90°
• Cell volume: 3810 ± 1.2 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.1037
• Weighted residual factors for all reflections included in the refinement: 0.1095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No