Information card for entry 4129420

Structure parameters

• Formula: C286 H254 F24 N9 O51 Ru8 S8
• Calculated formula: C286 H244 F24 N9 O51 Ru8 S8
• Title of publication: Selective synthesis of ruthenium(II) Metalla[2]catenane via solvent and guest-dependent self-assembly.
• Authors of publication: Lee, HyeWoo; Elumalai, Palani; Singh, Nem; Kim, Hyunuk; Lee, Sang Uck; Chi, Ki-Whan
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 14
• Pages of publication: 4674 - 4677
• a: 29.291 ± 0.006 Å
• b: 38.789 ± 0.008 Å
• c: 28.633 ± 0.006 Å
• α: 90°
• β: 117.92 ± 0.03°
• γ: 90°
• Cell volume: 28745 ± 13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.1289
• Residual factor for significantly intense reflections: 0.1065
• Weighted residual factors for significantly intense reflections: 0.3235
• Weighted residual factors for all reflections included in the refinement: 0.3426
• Goodness-of-fit parameter for all reflections included in the refinement: 1.355
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No