Information card for entry 7211033

Structure parameters

• Formula: C69 H50 In2 N4 O14
• Calculated formula: C69 H50 In2 N4 O14
• Title of publication: Indium metal‒organic frameworks as catalysts in solvent-free cyanosilylation reaction
• Authors of publication: Aguirre-Díaz, Lina María; Iglesias, Marta; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Monge, M. Ángeles
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 45
• Pages of publication: 9562
• a: 13.0268 ± 0.0004 Å
• b: 23.255 ± 0.0006 Å
• c: 10.1923 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3087.64 ± 0.15 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 34
• Hermann-Mauguin space group symbol: P n n 2
• Hall space group symbol: P 2 -2n
• Residual factor for all reflections: 0.0978
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1544
• Weighted residual factors for all reflections included in the refinement: 0.1814
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No