Information card for entry 7025276

Structure parameters

• Formula: C40 H28 Ag2 N10 O6
• Calculated formula: C40 H28 Ag2 N10 O6
• SMILES: N(=O)(=O)O[Ag]12[n]3c(cccc3)c3ccn(Cc4ccc(c5c4cccc5)C#[N][Ag]4(ON(=O)=O)[n]5c(cccc5)c5ccn(Cc6ccc(c7c6cccc7)C#[N]2)[n]45)[n]13
• Title of publication: Hierarchical self-assembly of heteronuclear co-ordination networks.
• Authors of publication: Fenton, Hazel; Tidmarsh, Ian S.; Ward, Michael D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 16
• Pages of publication: 3805 - 3815
• a: 7.5051 ± 0.0004 Å
• b: 18.8729 ± 0.0009 Å
• c: 12.8752 ± 0.0006 Å
• α: 90°
• β: 96.361 ± 0.003°
• γ: 90°
• Cell volume: 1812.45 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0314
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.0597
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No