Information card for entry 7026996

Structure parameters

• Formula: C18 H42 Ag2 Cu2 N11 O11
• Calculated formula: C18 H42 Ag2 Cu2 N11 O11
• SMILES: [Cu]123([N]4(CC[N]1(CC[N]2(CC4)C)C)C)[OH][Cu]12([N]4(CC[N]1(CC[N]2(CC4)C)C)C)[N](O3)=O.[Ag]12([O]=NO1)([O]=NO2)[N]1=[O][Ag](O1)N(=O)=O
• Title of publication: A μ-hydroxy-μ-nitritodicopper(II) core embedded in a AgNO2 matrix: synthesis, structure and magnetism
• Authors of publication: Flörke, Ulrich; Haupt, Hans-Jürgen; Chaudhuri, Phalguni
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 22
• Pages of publication: 3801
• a: 8.726 ± 0.002 Å
• b: 17.216 ± 0.003 Å
• c: 21.631 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3249.6 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1383
• Residual factor for significantly intense reflections: 0.0717
• Weighted residual factors for all reflections: 0.2013
• Weighted residual factors for significantly intense reflections: 0.1587
• Goodness-of-fit parameter for all reflections: 1.046
• Goodness-of-fit parameter for significantly intense reflections: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No