Information card for entry 7052703

Structure parameters

• Formula: C16 H24 F6 N3 P Ru
• Calculated formula: C16 H24 F6 N3 P Ru
• SMILES: [c]12([c]3([c]4([c]5([c]1([Ru]2345([N]#CC)([N]#CC)[N]#CC)C)C)C)C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: New copper(ii)-centered complexes with organometallic donor‒acceptor substituted unsymmetrical Schiff base ligands
• Authors of publication: Trujillo, Alexander; Justaud, Frédéric; Toupet, Loïc; Cador, Olivier; Carrillo, David; Manzur, Carolina; Hamon, Jean-René
• Journal of publication: New Journal of Chemistry
• Year of publication: 2011
• Journal volume: 35
• Journal issue: 10
• Pages of publication: 2027
• a: 19.373 ± 0.0005 Å
• b: 11.056 ± 0.0003 Å
• c: 19.6321 ± 0.0005 Å
• α: 90°
• β: 104.548 ± 0.002°
• γ: 90°
• Cell volume: 4070.14 ± 0.19 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0307
• Residual factor for significantly intense reflections: 0.0274
• Weighted residual factors for significantly intense reflections: 0.0798
• Weighted residual factors for all reflections included in the refinement: 0.0814
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No