Information card for entry 7108059

Structure parameters

• Formula: C5 H11 Gd O8
• Calculated formula: C5 H11 Gd O8
• Title of publication: Increasing the dimensionality of cryogenic molecular coolers: Gd-based polymers and metal-organic frameworks
• Authors of publication: Giulia Lorusso; Maria Palacios; Gary Nichol; Euan Brechin; Olivier Roubeau; Marco Evangelisti
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 7592
• a: 7.9966 ± 0.0004 Å
• b: 6.5839 ± 0.0002 Å
• c: 9.9447 ± 0.0004 Å
• α: 90°
• β: 109.425 ± 0.005°
• γ: 90°
• Cell volume: 493.77 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0364
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No