Information card for entry 7114391

Structure parameters

• Common name: la(cis-chdc)(trans-chdc)
• Formula: C16 H21 La O8
• Calculated formula: C16 H21 La O8
• Title of publication: Conformation change of the cyclohexanedicarboxylate ligand toward 2D and 3D La(iii)-organic coordination networks
• Authors of publication: Kim, YooJin; Jung, Duk-Young
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 8
• Pages of publication: 908
• a: 10.6994 ± 0.0015 Å
• b: 8.3352 ± 0.0015 Å
• c: 18.8774 ± 0.0013 Å
• α: 90°
• β: 96.774 ± 0.009°
• γ: 90°
• Cell volume: 1671.8 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0443
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.1154
• Weighted residual factors for all reflections included in the refinement: 0.1185
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No