Information card for entry 7712310

Structure parameters

• Formula: C42 H28 Dy N5 O8 S2
• Calculated formula: C42 H28 Dy N5 O8 S2
• Title of publication: A 2D Dy-based metal-organic framework derived from benzothiadiazole: structure and photocatalytic properties.
• Authors of publication: Zhu, Jing; Hua, Lin; Zhang, Yumeng; Wu, Hongying; Zheng, Fuwei; Shen, Hongyan; Gong, Haiyan; Yang, Liu; Jiang, Aiyun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 13
• Pages of publication: 4058 - 4062
• a: 7.7431 ± 0.0001 Å
• b: 13.8979 ± 0.0002 Å
• c: 18.5548 ± 0.0002 Å
• α: 105.082 ± 0.001°
• β: 101.879 ± 0.001°
• γ: 91.598 ± 0.001°
• Cell volume: 1879.65 ± 0.04 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0384
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0991
• Weighted residual factors for all reflections included in the refinement: 0.0998
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No