Information card for entry 7705370

Structure parameters

• Formula: C42.17 H32 Cr F17.48 N8 O0.52 P2.83 S0.17
• Calculated formula: C42.174 H32 Cr F17.478 N8 O0.522 P2.826 S0.174
• Title of publication: Luminescent polypyridyl heteroleptic Cr^III complexes with high quantum yields and long excited state lifetimes.
• Authors of publication: Jiménez, Juan-Ramón; Poncet, Maxime; Doistau, Benjamin; Besnard, Céline; Piguet, Claude
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 39
• Pages of publication: 13528 - 13532
• a: 17.10349 ± 0.00006 Å
• b: 17.98863 ± 0.00008 Å
• c: 28.79512 ± 0.00012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8859.35 ± 0.06 ų
• Cell temperature: 149.99 ± 0.1 K
• Ambient diffraction temperature: 149.99 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0459
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1206
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No