Information card for entry 4069499

Structure parameters

• Formula: C23 H28 Cu N3
• Calculated formula: C23 H28 Cu N3
• SMILES: [Cu]1(N(C(=CC(=[N]1[C@H](c1ccccc1)C)C)C)[C@H](c1ccccc1)C)[N]#CC
• Title of publication: Bis(2-phenylethyl)-nacnac: A Chiral Diketiminate Ligand and Its Copper Complexes
• Authors of publication: Oguadinma, Paul O.; Schaper, Frank
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 14
• Pages of publication: 4089
• a: 7.1 ± 0.0003 Å
• b: 8.6253 ± 0.0004 Å
• c: 33.9399 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2078.47 ± 0.17 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0298
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0646
• Weighted residual factors for all reflections included in the refinement: 0.0654
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No