Information card for entry 4321175

Structure parameters

• Formula: C72 H102 Eu3 O12
• Calculated formula: C72 H102 Eu3 O12
• SMILES: [Eu]12([O](c3c(cccc3C)C)[Eu]34([O]2c2c(cccc2C)C)([O]1c1c(cccc1C)C)[O](c1c(C)cccc1C)[Eu]([O]3c1c(cccc1C)C)([O]4c1c(cccc1C)C)([O]1CCCC1)([O]1CCCC1)[O]1CCCC1)([O]1CCCC1)([O]1CCCC1)[O]1CCCC1
• Title of publication: Reactivity of "Eu(OiPr)2" with Phenols: Formation of Linear Eu3, Square Pyramidal Eu5, Cubic Eu8, and Capped Cubic Eu9 Polymetallic Europium Complexes
• Authors of publication: William J. Evans; Michael A. Greci; Joseph W. Ziller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 3213 - 3220
• a: 12.0468 ± 0.0006 Å
• b: 11.9257 ± 0.0006 Å
• c: 24.2959 ± 0.0013 Å
• α: 90°
• β: 100.119 ± 0.001°
• γ: 90°
• Cell volume: 3436.2 ± 0.3 ų
• Cell temperature: 158 ± 2 K
• Ambient diffraction temperature: 158 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1428
• Residual factor for significantly intense reflections: 0.102
• Weighted residual factors for significantly intense reflections: 0.2361
• Weighted residual factors for all reflections included in the refinement: 0.2609
• Goodness-of-fit parameter for all reflections included in the refinement: 1.223
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No