Information card for entry 4327103

Structure parameters

• Formula: C7 H12 Ag Br N2 O7 S
• Calculated formula: C7 H12 Ag Br N2 O7 S
• SMILES: [Ag]([OH2])(OC(=O)c1c(O)c(S(=O)(=O)[O-])cc(Br)c1)[NH3].[NH4+]
• Title of publication: New Family of Silver(I) Complexes Based on Hydroxyl and Carboxyl Groups Decorated Arenesulfonic Acid: Syntheses, Structures, and Luminescent Properties
• Authors of publication: Xiang-Qian Fang; Zhao-Peng Deng; Li-Hua Huo; Wang Wan; Zhi-Biao Zhu; Hui Zhao; Shan Gao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 12562 - 12574
• a: 7.5987 ± 0.0015 Å
• b: 9.4869 ± 0.0019 Å
• c: 9.592 ± 0.0019 Å
• α: 93.83 ± 0.03°
• β: 105.8 ± 0.03°
• γ: 94.93 ± 0.03°
• Cell volume: 659.9 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0647
• Residual factor for significantly intense reflections: 0.0576
• Weighted residual factors for significantly intense reflections: 0.1561
• Weighted residual factors for all reflections included in the refinement: 0.1663
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No