Information card for entry 7150205

Structure parameters

• Formula: C172.23 H106 Cl3.11 F12 N6 O15 P2 Ru
• Calculated formula: C172.355 H106 Cl3.058 F12 N6 O15 P2 Ru
• Title of publication: Synthesis of achiral and racemic catenanes based on terpyridine and a directionalized terpyridine mimic, pyridyl-phenanthroline.
• Authors of publication: Loren, Jon C.; Gantzel, Peter; Linden, Anthony; Siegel, Jay S.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2005
• Journal volume: 3
• Journal issue: 17
• Pages of publication: 3105 - 3116
• a: 16.1362 ± 0.0014 Å
• b: 17.4816 ± 0.0016 Å
• c: 30.711 ± 0.003 Å
• α: 77.635 ± 0.002°
• β: 75.632 ± 0.002°
• γ: 65.267 ± 0.002°
• Cell volume: 7562.2 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1317
• Residual factor for significantly intense reflections: 0.098
• Weighted residual factors for significantly intense reflections: 0.2824
• Weighted residual factors for all reflections included in the refinement: 0.3071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No