Information card for entry 7225431

Structure parameters

• Formula: C56 H40 N2 O16 Zn3
• Calculated formula: C56 H40 N2 O16 Zn3
• Title of publication: Eight Zn(II) and Cd(II) complexes based on the aromatic C-centered triangular multicarboxylate and N-donor mixed ligands
• Authors of publication: Nie, Ai-Yang; Tong, Yong-Li; Zhou, Hu; Cao, Ling-Ling; Yu, Hui; Shi, Chao; Yuan, Aihua
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 9.405 ± 0.003 Å
• b: 13.541 ± 0.003 Å
• c: 14.045 ± 0.002 Å
• α: 116.75 ± 0.02°
• β: 90.123 ± 0.01°
• γ: 106.568 ± 0.018°
• Cell volume: 1513 ± 0.7 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1118
• Weighted residual factors for all reflections included in the refinement: 0.1186
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No