Information card for entry 2017520

Structure parameters

• Chemical name: bis(μ~2~-methylquinolin-8-olato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>; κ^3^<i>O</i>:<i>N</i>,<i>O</i>)bis[(thiocyanato-κ<i>N</i>)lead(II)]
• Formula: C22 H16 N4 O2 Pb2 S2
• Calculated formula: C22 H16 N4 O2 Pb2 S2
• SMILES: Cc1ccc2cccc3c2[n]1[Pb]1(N=C=S)[O]3[Pb]2([n]3c(ccc4cccc(c34)[O]12)C)N=C=S
• Title of publication: Two polymorphs of a lead(II) complex with 8-hydroxy-2-methylquinoline and thiocyanate
• Authors of publication: Mohammadnezhad, Gholamhossein; Amini, Mostafa M.; Langer, Vratislav
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 2
• Pages of publication: m44 - m47
• a: 12.037 ± 0.005 Å
• b: 5.731 ± 0.002 Å
• c: 16.327 ± 0.006 Å
• α: 90°
• β: 90.368 ± 0.007°
• γ: 90°
• Cell volume: 1126.3 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0659
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes