Information card for entry 2233310

Structure parameters

• Formula: C31 H15 Ag N6 O11
• Calculated formula: C31 H15 Ag N6 O11
• SMILES: [Ag]12([n]3cccc4C(C(c5ccc[n]1c5c34)=O)=O)[n]1cccc3C(=O)C(=O)c4ccc[n]2c4c13.O=C(c1c(c(cc(c1)N(=O)=O)N(=O)=O)O)[O-]
• Title of publication: Bis(1,10-phenanthroline-5,6-dione-κ^2^<i>N</i>,<i>N</i>')silver(I) 2-hydroxy-3,5-dinitrobenzoate
• Authors of publication: Wang, Shen-Tang; Che, Guang-Bo; Liu, Chun-Bo; Wang, Xing; Liu, Ling
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 1
• Pages of publication: m76
• a: 11.757 ± 0.002 Å
• b: 18.297 ± 0.004 Å
• c: 13.223 ± 0.003 Å
• α: 90°
• β: 103.91 ± 0.03°
• γ: 90°
• Cell volume: 2761.1 ± 1.1 ų
• Cell temperature: 173.5 K
• Ambient diffraction temperature: 173.5 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: 0.1065
• Residual factor for significantly intense reflections: 0.0829
• Weighted residual factors for significantly intense reflections: 0.1504
• Weighted residual factors for all reflections included in the refinement: 0.1633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes