Information card for entry 7243489

Structure parameters

• Chemical name: catena-[(m-N,N''-(biphenyl-4,4'-diyl)diisonicotinamide)-bis(m-biphenyl-4,4'-dicarboxylato)-di-zinc(ii)guest N,N-dimethylformamide solvate]
• Formula: C94 H83 N8 O18 Zn3
• Calculated formula: C94 H83 N8 O18 Zn3
• Title of publication: Stabilization of liquid active guests via nanoconfinement into a flexible microporous metal–organic framework
• Authors of publication: Mazzeo, Paolo P.; Balestri, Davide; Bacchi, Alessia; Pelagatti, Paolo
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 41
• Pages of publication: 7262 - 7269
• a: 15.186 ± 0.003 Å
• b: 15.21 ± 0.003 Å
• c: 26.964 ± 0.005 Å
• α: 91.53 ± 0.03°
• β: 102.04 ± 0.03°
• γ: 91.69 ± 0.03°
• Cell volume: 6085 ± 2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0713
• Residual factor for significantly intense reflections: 0.0705
• Weighted residual factors for significantly intense reflections: 0.2002
• Weighted residual factors for all reflections included in the refinement: 0.2007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No