Information card for entry 7206243

Structure parameters

• Formula: C19 H13.5 In N O5.25
• Calculated formula: C19 H13 In N O5.25
• Title of publication: Three novel indium MOFs derived from diphenic acid: synthesis, crystal structures and supramolecular chemistry
• Authors of publication: Platero-Prats, Ana E.; Bernini, María C.; Medina, Manuela E.; López-Torres, Elena; Gutiérrez-Puebla, Enrique; Ángeles Monge, M.; Snejko, Natalia
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 15
• Pages of publication: 4965
• a: 10.7789 ± 0.0003 Å
• b: 8.2923 ± 0.0002 Å
• c: 19.6538 ± 0.0005 Å
• α: 90°
• β: 95.031 ± 0.001°
• γ: 90°
• Cell volume: 1749.93 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0918
• Residual factor for significantly intense reflections: 0.0739
• Weighted residual factors for significantly intense reflections: 0.2276
• Weighted residual factors for all reflections included in the refinement: 0.2452
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No