Information card for entry 4331979

Structure parameters

• Formula: C54.8 H57.2 Br2 F12 N10.4 P2 Ru
• Calculated formula: C54.8 H57.2 Br2 F12 N10.4 P2 Ru
• Title of publication: A Novel Heteroditopic Terpyridine-Pincer Ligand as Building Block for Mono- and Heterometallic Pd(II) and Ru(II) Complexes
• Authors of publication: Gagliardo, Marcella; Rodríguez, Gema; Dam, Henk H.; Lutz, Martin; Spek, Anthony L.; Havenith, Remco W. A.; Coppo, Paolo; De Cola, Luisa; Hartl, František; van Klink, Gerard P. M.; van Koten, Gerard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 2143 - 2155
• a: 11.1057 ± 0.0002 Å
• b: 14.4557 ± 0.0002 Å
• c: 20.2558 ± 0.0004 Å
• α: 88.9444 ± 0.0006°
• β: 84.747 ± 0.0005°
• γ: 68.7656 ± 0.0006°
• Cell volume: 3017.99 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.077
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.1736
• Weighted residual factors for all reflections included in the refinement: 0.1847
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No