Information card for entry 7102343

Structure parameters

• Formula: C99 H81 Ag6 F9 N12 O18 S3
• Calculated formula: C99 H81 Ag6 F9 N12 O18 S3
• SMILES: [Ag]1n2c3c4cc5c6n7[Ag][N]8=C(OC[C@H]8c8ccccc8)c8cc(cc(C9=[N]1[C@@H](CO9)c1ccccc1)c8)C1=[N]([Ag]n8c(c(c4)c5)[n]([Ag][N]4=C(OC[C@H]4c4ccccc4)c4cc(C5=[N]([Ag][n]3c3c2cccc3)[C@@H](CO5)c2ccccc2)cc(C2=[N]([Ag][n]6c3c7cccc3)[C@@H](CO2)c2ccccc2)c4)c2c8cccc2)[C@@H](CO1)c1ccccc1.CO.C(F)(F)(F)S(=O)(=O)[O-].CO.CO.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]
• Title of publication: A hamburger-shaped helical stacking of disk-shaped ligands mediated by silver(II) ions.
• Authors of publication: Lee, Ho Yong; Park, Jaejoon; Lah, Myoung Soo; Hong, Jong-In
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 47
• Pages of publication: 5013 - 5015
• a: 25.47 ± 0.004 Å
• b: 25.47 ± 0.004 Å
• c: 13.028 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7319 ± 2 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 7
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1099
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No