Information card for entry 4330298

Structure parameters

• Formula: C62 H74 Cd2 N6 O25
• Calculated formula: C62 H74 Cd2 N6 O25
• Title of publication: Encapsulation and Sensitization of UV-vis and Near Infrared Lanthanide Hydrate Emitters for Dual- and Bimodal-Emissions in Both Air and Aqueous Media Based on a Porous Heteroatom-Rich Cd(II)-Framework
• Authors of publication: Yan-An Li; Shu-Kui Ren; Qi-Kui Liu; Jian-Ping Ma; Xueyuan Chen; Haomiao Zhu; Yu-Bin Dong
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 9629 - 9635
• a: 22.5663 ± 0.0014 Å
• b: 22.5663 ± 0.0014 Å
• c: 13.8877 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7072.1 ± 1.1 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.0945
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No