Information card for entry 4302626

Structure parameters

• Formula: C9 H5 Na O7 Pb
• Calculated formula: C9 H5 Na O7 Pb
• SMILES: O=C(c1cc(cc(c1)C(=O)[O-])C(=O)[O-])[O-].O.[Pb+2].[Na+]
• Title of publication: Synthesis, Structure, and Luminescent Properties of Hybrid Inorganic-Organic Framework Materials Formed by Lead Aromatic Carboxylates: Inorganic Connectivity Variation from 0D to 3D
• Authors of publication: Lei Zhang; Zhao-Ji Li; Qi-Pu Lin; Ye-Yan Qin; Jian Zhang; Pei-Xiu Yin; Jian-Kai Cheng; Yuan-Gen Yao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 6517 - 6525
• a: 6.418 ± 0.002 Å
• b: 10.099 ± 0.003 Å
• c: 17.553 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1137.7 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0198
• Weighted residual factors for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.0614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No