Information card for entry 7225435

Structure parameters

• Formula: C70 H56 Cd3 N6 O16
• Calculated formula: C70 H56 Cd3 N6 O16
• 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: 13.179 ± 0.002 Å
• b: 13.63 ± 0.002 Å
• c: 13.915 ± 0.002 Å
• α: 64.597 ± 0.003°
• β: 79.867 ± 0.004°
• γ: 64.592 ± 0.003°
• Cell volume: 2039.4 ± 0.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0669
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.1116
• Weighted residual factors for all reflections included in the refinement: 0.1154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No