Information card for entry 4070471

Structure parameters

• Formula: C52 H52 Cu2 N4
• Calculated formula: C52 H52 Cu2 N4
• SMILES: [Cu]123(N(C(=CC(=[N]1Cc1ccccc1)C)C)Cc1ccccc1)[Cu]14(N(C(=CC(=[N]1Cc1ccccc1)C)C)Cc1ccccc1)[C]2(c1ccccc1)=[C]34c1ccccc1
• Title of publication: π Back-Bonding in Dibenzyl-β-diketiminato Copper Olefin Complexes
• Authors of publication: Oguadinma, Paul O.; Schaper, Frank
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 23
• Pages of publication: 6721
• a: 11.317 ± 0.002 Å
• b: 11.331 ± 0.002 Å
• c: 36.015 ± 0.007 Å
• α: 93.52 ± 0.006°
• β: 98.623 ± 0.006°
• γ: 105.864 ± 0.005°
• Cell volume: 4366.7 ± 1.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2164
• Residual factor for significantly intense reflections: 0.1084
• Weighted residual factors for significantly intense reflections: 0.2739
• Weighted residual factors for all reflections included in the refinement: 0.3258
• Goodness-of-fit parameter for all reflections included in the refinement: 0.952
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No