Information card for entry 7206242

Structure parameters

• Formula: C66 H42 In2 N4 O13
• Calculated formula: C66 H40 In2 N4 O13
• 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: 9.835 ± 0.002 Å
• b: 13.839 ± 0.003 Å
• c: 21.881 ± 0.005 Å
• α: 96.492 ± 0.004°
• β: 100.32 ± 0.005°
• γ: 104.967 ± 0.004°
• Cell volume: 2790.5 ± 1.1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.1247
• Residual factor for significantly intense reflections: 0.0752
• Weighted residual factors for significantly intense reflections: 0.1614
• Weighted residual factors for all reflections included in the refinement: 0.2003
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No