Information card for entry 4504923

Structure parameters

• Formula: C5 H4 N2 O4 Zn
• Calculated formula: C5 H4 N2 O4 Zn
• Title of publication: Synthesis and Characterization of Four Novel Supramolecular Compounds Based on Metal Zinc and Cadmium
• Authors of publication: Lu, Jing; Zhao, Kui; Fang, Qian-Rong; Xu, Ji-Qing; Yu, Jie-Hui; Zhang, Xiao; Bie, Hai-Ying; Wang, Tie-Gang
• Journal of publication: Crystal Growth & Design
• Year of publication: 2005
• Journal volume: 5
• Journal issue: 3
• Pages of publication: 1091
• a: 8.4292 ± 0.0006 Å
• b: 9.4026 ± 0.0007 Å
• c: 8.276 ± 0.0006 Å
• α: 90°
• β: 93.156 ± 0.001°
• γ: 90°
• Cell volume: 654.93 ± 0.08 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 571 ± 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: 0.031
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No