Information card for entry 1563830

Structure parameters

• Formula: C17 H18 Cl Ge N O3
• Calculated formula: C17 H18 Cl Ge N O3
• SMILES: [Ge@@]12(Cl)(Oc3c(c4ccccc4cc3)C=[N]2[C@H](C(=O)O1)C(C)C)C
• Title of publication: (S)-N-[(2-hydroxynaphthalen-1-yl)methylidene]valine ‒ A valuable ligand for the preparation of chiral complexes
• Authors of publication: Schwarzer, Sandra; Böhme, Uwe; Fels, Sabine; Günther, Betty; Brendler, Erica
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2018
• Journal volume: 483
• Pages of publication: 136 - 147
• a: 9.3138 ± 0.0003 Å
• b: 10.8417 ± 0.0005 Å
• c: 16.9196 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1708.5 ± 0.11 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• 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: 0.0258
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.0575
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No