Information card for entry 4519219

Structure parameters

• Chemical name: Zn-TATB
• Formula: C26 H18 Cl0.25 N4 O6 Zn1.5
• Calculated formula: C26 H18 Cl0.25 N4 O6 Zn1.5
• Title of publication: Template-Directed Fabrication of Highly Efficient Metal-Organic Framework Photocatalysts.
• Authors of publication: Liu, Wansheng; Yang, Yi; Yang, Xiaojie; Peng, Yun-Lei; Cheng, Peng; Zhang, Zhenjie; Chen, Yao
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2021
• Journal volume: 13
• Journal issue: 49
• Pages of publication: 58619 - 58629
• a: 17.958 ± 0.0002 Å
• b: 17.958 ± 0.0002 Å
• c: 26.0252 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8392.9 ± 0.2 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 6
• Space group number: 95
• Hermann-Mauguin space group symbol: P 43 2 2
• Hall space group symbol: P 4cw 2c
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1547
• Weighted residual factors for all reflections included in the refinement: 0.1633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No