Information card for entry 4069504

Structure parameters

• Formula: C25 H29 N3 O2
• Calculated formula: C25 H29 N3 O2
• SMILES: O=C1N(C(=C(N[C@@H](c2ccccc2)C)C)C(=N\[C@@H](c2ccccc2)C)\C)C(=O)CC1
• 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: 9.7805 ± 0.0003 Å
• b: 12.5052 ± 0.0004 Å
• c: 17.9988 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2201.38 ± 0.12 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: 0.0438
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No