Information card for entry 1563825

Structure parameters

• Formula: C21 H25 N O3 Si
• Calculated formula: C21 H25 N O3 Si
• SMILES: [Si]123(Oc4c(c5ccccc5cc4)C=[N]2[C@H](C(=O)O1)C(C)C)CCCCC3
• 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: 11.4794 ± 0.0005 Å
• b: 11.4794 ± 0.0005 Å
• c: 13.1483 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1500.51 ± 0.12 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.0967
• Weighted residual factors for all reflections included in the refinement: 0.1006
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No