Information card for entry 4501617

Structure parameters

• Formula: C18 H24 N4 O5 Zn
• Calculated formula: C18 H24 N4 O5 Zn
• SMILES: [C@H]1(C)[NH]2Cc3cccc[n]3[Zn]342([NH]([C@@H](C(=O)O4)C)Cc2cccc[n]32)OC1=O.O
• Title of publication: Homochiral Supramolecular Compounds Constructed from Amino Acid Derivatives: Syntheses, Structures, Chiroptical, and Photoluminescence Properties
• Authors of publication: Li, Xinfa; Liu, Tianfu; Hu, Bing; Li, Guoliang; Zhang, Hui; Cao, Rong
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 7
• Pages of publication: 3051
• a: 5.607 ± 0.002 Å
• b: 19.511 ± 0.008 Å
• c: 18.564 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2030.9 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.0256
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0482
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No