Information card for entry 2225335

Structure parameters

• Chemical name: Bis(μ-iminodiacetato)bis[(2,2'-diamino-4,4'-bi-1,3-thiazole)lead(II)] tetrahydrate
• Formula: C20 H30 N10 O12 Pb2 S4
• Calculated formula: C20 H30 N10 O12 Pb2 S4
• SMILES: [NH]12[Pb]3([n]4c(csc4N)c4csc([n]34)N)(OC(=O)C1)OC(=O)C2.O.O
• Title of publication: Bis(μ-iminodiacetato)bis[(2,2'-diamino-4,4'-bi-1,3-thiazole)lead(II)] tetrahydrate
• Authors of publication: Du, Mei; Liu, Bing-Xin; Nie, Jing-Jing; Xu, Duan-Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: m343 - m344
• a: 9.2241 ± 0.0008 Å
• b: 9.8526 ± 0.0009 Å
• c: 10.638 ± 0.0011 Å
• α: 77.0732 ± 0.0012°
• β: 67.4141 ± 0.0015°
• γ: 69.069 ± 0.0012°
• Cell volume: 829.54 ± 0.14 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0211
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes