Information card for entry 7231989

Structure parameters

• Chemical name: catena-(tris(μ4-1,1'-biphenyl-4,4'-dicarboxylato)-tris-cobalt bis(N,N-dimethylformamide)
• Formula: C24 H19 Co1.5 N O7
• Calculated formula: C24 H19 Co1.5 N O7
• Title of publication: MOF transmetalation beyond cation substitution: defective distortion of IRMOF-9 in the spotlight
• Authors of publication: Canossa, Stefano; Fornasari, Luca; Demitri, Nicola; Mattarozzi, Monica; Choquesillo-Lazarte, Duane; Pelagatti, Paolo; Bacchi, Alessia
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 5
• Pages of publication: 827
• a: 11.0222 ± 0.0014 Å
• b: 15.1754 ± 0.0019 Å
• c: 19.331 ± 0.003 Å
• α: 90°
• β: 100.256 ± 0.004°
• γ: 90°
• Cell volume: 3181.8 ± 0.8 ų
• Cell temperature: 353 K
• Ambient diffraction temperature: 353 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0508
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0892
• Weighted residual factors for all reflections included in the refinement: 0.0937
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No