Information card for entry 7223895

Structure parameters

• Formula: C31 H43 La N6 O14
• Calculated formula: C20 H14 La N2 O10
• Title of publication: Nanoporous lanthanide metal‒organic frameworks as efficient heterogeneous catalysts for the Henry reaction
• Authors of publication: Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Paul, Anup; Pombeiro, Armando J. L.
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 8
• Pages of publication: 1337
• a: 27.0059 ± 0.0007 Å
• b: 27.0059 ± 0.0007 Å
• c: 27.0059 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 19695.9 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 206
• Hermann-Mauguin space group symbol: I a -3
• Hall space group symbol: -I 2b 2c 3
• Residual factor for all reflections: 0.0844
• Residual factor for significantly intense reflections: 0.0648
• Weighted residual factors for significantly intense reflections: 0.1907
• Weighted residual factors for all reflections included in the refinement: 0.223
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No