Information card for entry 7126059

Structure parameters

• Formula: C43 H62 N6 O8 Zn
• Calculated formula: C43 H62 N6 O8 Zn
• SMILES: [Zn]123([N]4(C[C@H]([N]1(CC[N]2(CC[N]3(CC4)Cc1ccc(cc1)C)Cc1ccc(cc1)C)Cc1ccc(cc1)C)C)Cc1ccc(cc1)C)ON(=O)=O.N(=O)(=O)[O-].CO.OC
• Title of publication: Silver ion-induced chiral enhancement by argentivorous molecules.
• Authors of publication: Lee, Eunji; Hosoi, Yasuhiro; Temma, Honoka; Ju, Huiyeong; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 23
• Pages of publication: 3373 - 3376
• a: 8.7797 ± 0.0007 Å
• b: 19.0092 ± 0.0015 Å
• c: 12.9597 ± 0.001 Å
• α: 90°
• β: 90.5449 ± 0.0016°
• γ: 90°
• Cell volume: 2162.8 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0965
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1182
• Weighted residual factors for all reflections included in the refinement: 0.1404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No