Information card for entry 7707605

Structure parameters

• Chemical name: 2-{(E)-((R)-1-(phenyl)ethylimino)(phenyl)methyl}phenol
• Formula: C21 H19 N O
• Calculated formula: C21 H19 N O
• SMILES: Oc1c(cccc1)/C(=N/[C@@H](c1ccccc1)C)c1ccccc1
• Title of publication: Pseudotetrahedral copper(II)-complexes with enantiopure (<i>R</i> or <i>S</i>)-2-(((aryl)ethylimino)ethyl)phenolate Schiff base ligands.
• Authors of publication: Enamullah, Mohammed; Anwar Hossain, Mohammad; Islam, Mohammad Khairul; Woschko, Dennis; Janiak, Christoph
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 26
• Pages of publication: 9236 - 9249
• a: 9.9056 ± 0.0005 Å
• b: 8.139 ± 0.0004 Å
• c: 10.8874 ± 0.0005 Å
• α: 90°
• β: 111.182 ± 0.002°
• γ: 90°
• Cell volume: 818.46 ± 0.07 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0261
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0658
• Weighted residual factors for all reflections included in the refinement: 0.066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No