Information card for entry 2016846

Structure parameters

• Chemical name: Poly[(μ~2~-aqua-κ^2^<i>O</i>:<i>O</i>)(μ~3~-azido- κ^3^<i>N</i>^1^:<i>N</i>^3^:<i>N</i>^3^)(μ~2~-isonicotinato- κ^2^<i>O</i>:<i>O</i>')lead(II)]
• Formula: C6 H6 N4 O3 Pb
• Calculated formula: C6 H6 N4 O3 Pb
• SMILES: C(=O)(c1ccncc1)[O-].[Pb+2].N#N=[N-].O
• Title of publication: Poly[(μ~2~-aqua-κ^2^<i>O</i>:<i>O</i>)(μ~3~-azido-κ^3^<i>N</i>^1^:<i>N</i>^1^:<i>N</i>^3^)(μ~2~-isonicotinato-κ^2^<i>O</i>:<i>O</i>')lead(II)]
• Authors of publication: Huang, Gansheng; Liu, Dongsheng; Huang, Xihe; Huang, Changcang; Qin, Xiaohuan
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 11
• Pages of publication: m369 - m371
• a: 10.815 ± 0.002 Å
• b: 12.963 ± 0.003 Å
• c: 6.3422 ± 0.0013 Å
• α: 90°
• β: 105.33 ± 0.03°
• γ: 90°
• Cell volume: 857.5 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.046
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for significantly intense reflections: 0.1254
• Weighted residual factors for all reflections included in the refinement: 0.1273
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes