Information card for entry 1514969

Structure parameters

• Formula: C56 H48 Ag2 F12 N12 O4 P2
• Calculated formula: C56 H48 Ag2 F12 N12 O4 P2
• SMILES: [Ag]1=C2N(N=C3N2[C@@H](c2ccccc2)COC3)c2cccc(N3N=C4N(C3=[Ag]=C3N(N=C5N3[C@@H](c3ccccc3)COC5)c3cccc(N5N=C6N(C=15)[C@@H](COC6)c1ccccc1)c3)[C@@H](COC4)c1ccccc1)c2.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes
• Authors of publication: Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong
• Journal of publication: Chemical Science
• Year of publication: 2012
• Journal volume: 3
• Journal issue: 2
• Pages of publication: 359
• a: 14.883 ± 0.009 Å
• b: 11.843 ± 0.01 Å
• c: 19.893 ± 0.01 Å
• α: 90°
• β: 118.38 ± 0.04°
• γ: 90°
• Cell volume: 3085 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.2709
• Residual factor for significantly intense reflections: 0.0982
• Weighted residual factors for significantly intense reflections: 0.2019
• Weighted residual factors for all reflections included in the refinement: 0.2388
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No