Information card for entry 7205602

Structure parameters

• Common name: work
• Formula: C34 H40 Ag2 F12 N8 P2
• Calculated formula: C34 H40 Ag2 F12 N8 P2
• SMILES: c1[n]2[Ag][n]3cn(Cc4c(cc(c(Cn5c[n](cc5)[Ag][n]5cn(Cc6c(cc(c(Cn(c2)c1)c6C)C)C)cc5)c4C)C)C)cc3.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Anion directed supramolecular architectures of silver(i) complexes with 1,3-bis(imidazol-1-ylmethyl)-2,4,6-trimethylbenzene and a reversible, solvent-induced structural change during a single-crystal-to-single-crystal transformation
• Authors of publication: Dobrzańska, Liliana
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 7
• Pages of publication: 2303
• a: 8.8539 ± 0.0014 Å
• b: 9.3957 ± 0.0015 Å
• c: 12.052 ± 0.0019 Å
• α: 92.737 ± 0.002°
• β: 102.777 ± 0.002°
• γ: 102.993 ± 0.002°
• Cell volume: 947.7 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0637
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1371
• Weighted residual factors for all reflections included in the refinement: 0.1424
• Goodness-of-fit parameter for all reflections included in the refinement: 1.156
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No