Information card for entry 7042759

Structure parameters

• Formula: C47 H70 Al Er N2 O5 Si
• Calculated formula: C46.998 H69.9955 Al Er N2 O5 Si
• Title of publication: Molecular rare earth metal alumosilicates
• Authors of publication: Huerta-Lavorie, Raúl; Báez-Rodríguez, Dana V.; García-Ríos, Jessica; Martínez-Vollbert, Emiliano; Martínez-Otero, Diego; Jancik, Vojtech
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 11.1759 ± 0.0004 Å
• b: 13.1592 ± 0.0004 Å
• c: 17.2603 ± 0.0006 Å
• α: 84.9083 ± 0.0007°
• β: 75.4126 ± 0.0007°
• γ: 69.1769 ± 0.0006°
• Cell volume: 2296.12 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0228
• Residual factor for significantly intense reflections: 0.0199
• Weighted residual factors for significantly intense reflections: 0.0467
• Weighted residual factors for all reflections included in the refinement: 0.0481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No