Information card for entry 7250694

Structure parameters

• Chemical name: Ni-bdp
• Formula: C12 H8 N4 Ni O2
• Calculated formula: C12 H8 N4 Ni O2
• Title of publication: The use of a dynamic solvent system as a novel approach to sustainable MOF crystallization
• Authors of publication: Shupletsov, Leonid; Schieck, Alina C.; Senkovska, Irena; Bon, Volodymyr; Kaskel, Stefan
• Journal of publication: Green Chemistry
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 34
• Pages of publication: 10218 - 10233
• a: 22 ± 0.004 Å
• b: 6.93 ± 0.0014 Å
• c: 14.76 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2250.3 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 74
• Hermann-Mauguin space group symbol: I m m a
• Hall space group symbol: -I 2b 2
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.2059
• Weighted residual factors for all reflections included in the refinement: 0.212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.206
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No