Information card for entry 4332330

Structure parameters

• Formula: C31 H39 Cl N4 O8 Pb
• Calculated formula: C31 H39 Cl N4 O8 Pb
• SMILES: [Pb]1234567[O]8CC[N]2(CC[O]5CC[O]3CC[N]1(Cc1c([N]4=Cc2c(cccc2)O6)cccc1)CC8)Cc1ccccc1[NH2]7.Cl(=O)(=O)(=O)[O-]
• Title of publication: Lone-Pair Activity in Lead(II) Complexes with Unsymmetrical Lariat Ethers
• Authors of publication: Esteban-Gómez, David; Platas-Iglesias, Carlos; Enríquez-Pérez, Teresa; Avecilla, Fernando; de Blas, Andrés; Rodríguez-Blas, Teresa
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 5407 - 5416
• a: 13.705 ± 0.0018 Å
• b: 14.721 ± 0.002 Å
• c: 16.22 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3272.4 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.2302
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1387
• Goodness-of-fit parameter for all reflections included in the refinement: 0.934
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No