Information card for entry 7012139

Structure parameters

• Formula: C41 H22 Cl F9 N4 Nd O9 Re S3
• Calculated formula: C41 H22 Cl F9 N4 Nd O9 Re S3
• Title of publication: A simple, general synthesis of mixed d‒f complexes containing both {Re(CO)3Cl(diimine)} and lanthanide-tris(β-diketonate) luminophores linked by bis-diimine bridging ligands
• Authors of publication: Nail M. Shavaleev; Zöe R. Bell; Michael D. Ward
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 21
• Pages of publication: 3925 - 3927
• a: 8.8 ± 0.003 Å
• b: 38.712 ± 0.008 Å
• c: 13.527 ± 0.003 Å
• α: 90°
• β: 100.45 ± 0.02°
• γ: 90°
• Cell volume: 4532 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 9
• 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: 0.0976
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.0851
• Weighted residual factors for all reflections included in the refinement: 0.0989
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No