Information card for entry 7039149

Structure parameters

• Common name: Re-L0_OH
• Formula: C17 H22 Br N2 O11 P2 Re
• Calculated formula: C17 H22 Br N2 O11 P2 Re
• Title of publication: Synthesis and characterization of ruthenium and rhenium dyes with phosphonate anchoring groups.
• Authors of publication: Braumüller, Markus; Schulz, Martin; Staniszewska, Magdalena; Sorsche, Dieter; Wunderlin, Markus; Popp, Jürgen; Guthmuller, Julien; Dietzek, Benjamin; Rau, Sven
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 22
• Pages of publication: 9216 - 9228
• a: 6.265 ± 0.0002 Å
• b: 14.0611 ± 0.0007 Å
• c: 15.4117 ± 0.0006 Å
• α: 68.954 ± 0.004°
• β: 82.163 ± 0.003°
• γ: 81.699 ± 0.004°
• Cell volume: 1248.56 ± 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: 0.0395
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0851
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No