Information card for entry 7208244

Structure parameters

• Formula: C6 H8 Li N O8 S2
• Calculated formula: C6 H8 Li N O8 S2
• SMILES: c1(c(cc(c(c1)S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].[Li+].[NH4+]
• Title of publication: Syntheses, structures and luminescent properties of lithium(i)-sulfonate complexes constructed from ortho-hydroxyl arenedisulfonic acids: structural evolution tuned by the pH, coordination geometry and modes
• Authors of publication: Wan, Wang; Zhu, Zhi-Biao; Huo, Li-Hua; Deng, Zhao-Peng; Zhao, Hui; Gao, Shan
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 16
• Pages of publication: 5274
• a: 18.13 ± 0.004 Å
• b: 9.0962 ± 0.0018 Å
• c: 13.786 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2273.5 ± 0.8 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c a
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.0324
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0911
• Weighted residual factors for all reflections included in the refinement: 0.0922
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No