Information card for entry 7225566

Structure parameters

• Formula: C14 H12 N O5 Zn
• Calculated formula: C14 H12 N O5 Zn
• Title of publication: Crystal structures from 1D to 3D: triggered by the different coordination morphologies of ligands in different reaction systems
• Authors of publication: Wu, Yunlong; Yang, Guo-Ping; Liu, Jiao; Yan, Yangtian; Luan, Xinjun; Zhang, Wen-Yan; Wang, Yao-Yu
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 31
• Pages of publication: 5901
• a: 7.648 ± 0.002 Å
• b: 16.648 ± 0.005 Å
• c: 11.768 ± 0.003 Å
• α: 90°
• β: 115.798 ± 0.013°
• γ: 90°
• Cell volume: 1349 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1271
• Weighted residual factors for all reflections included in the refinement: 0.1851
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No