Information card for entry 7206611

Structure parameters

• Formula: C26 H36 N2 O10 Zn
• Calculated formula: C26 H36 N2 O10 Zn
• SMILES: [Zn](OC(=O)c1ccc(CN[C@@H](C(C)C)C(=O)O)cc1)(OC(=O)c1ccc(CN[C@@H](C(C)C)C(=O)O)cc1)([OH2])[OH2]
• Title of publication: Syntheses, crystal structures and optical properties of six homochiral coordination networks based on phenyl acid-amino acids
• Authors of publication: Yang, Xiu-Li; Xie, Ming-Hua; Zou, Chao; Wu, Chuan-De
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 21
• Pages of publication: 6422
• a: 21.96 ± 0.005 Å
• b: 5.8873 ± 0.0013 Å
• c: 10.731 ± 0.003 Å
• α: 90°
• β: 102.46 ± 0.02°
• γ: 90°
• Cell volume: 1354.7 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0666
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 0.924
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No