Information card for entry 4341076

Structure parameters

• Formula: C6 H12 N2 Ni O4
• Calculated formula: C6 H12 N2 Ni O4
• Title of publication: Zeolitic metal-organic frameworks based on amino Acid.
• Authors of publication: Yang, E.; Wang, Lin; Wang, Fei; Lin, Qipu; Kang, Yao; Zhang, Jian
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 19
• Pages of publication: 10027 - 10029
• a: 14.1407 ± 0.0002 Å
• b: 14.1407 ± 0.0002 Å
• c: 14.1407 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2827.57 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 197
• Hermann-Mauguin space group symbol: I 2 3
• Hall space group symbol: I 2 2 3
• Residual factor for all reflections: 0.048
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0885
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No