Information card for entry 7023476

Structure parameters

• Formula: C44 H36 Cl3 Cu F6 N2 O P3
• Calculated formula: C44 H36 Cl3 Cu F6 N2 O P3
• Title of publication: Phosphorescent properties of metal-free diphosphine ligands and effects of copper binding.
• Authors of publication: Yuasa, Junpei; Dan, Misato; Kawai, Tsuyoshi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 45
• Pages of publication: 16096 - 16101
• a: 9.34779 ± 0.00017 Å
• b: 26.3269 ± 0.0005 Å
• c: 19.0803 ± 0.0004 Å
• α: 90°
• β: 105.349 ± 0.0007°
• γ: 90°
• Cell volume: 4528.15 ± 0.15 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 8
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0634
• Weighted residual factors for all reflections included in the refinement: 0.1852
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No