Information card for entry 7250534

Structure parameters

• Formula: C7 H5 F2 N O
• Calculated formula: C7 H5 F2 N O
• Title of publication: Synthesis and structural analysis of a ZIF-9/GO composite for green catalytic C–C bond formation and N-formylation: a spectroscopic study
• Authors of publication: Kumari, Lalita; Mittal, Rupali; Khurana, Mehak; Awasthi, Satish Kumar
• Journal of publication: RSC Advances
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 24
• Pages of publication: 19500 - 19514
• a: 3.7817 ± 0.0003 Å
• b: 13.1946 ± 0.0008 Å
• c: 6.9708 ± 0.0005 Å
• α: 90°
• β: 103.654 ± 0.007°
• γ: 90°
• Cell volume: 338 ± 0.04 ų
• Cell temperature: 100 ± 0.3 K
• Ambient diffraction temperature: 100 ± 0.3 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0454
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1146
• Weighted residual factors for all reflections included in the refinement: 0.1191
• Goodness-of-fit parameter for all reflections included in the refinement: 0.909
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No