Information card for entry 7013759

Structure parameters

• Formula: C28 H43 N2 Si3 U
• Calculated formula: C28 H43 N2 Si3 U
• SMILES: [U]123456789%10%11%12([n]%13cnccc%13)([c]%13([Si](C)(C)C)[cH]1[cH]2[cH]3[cH]4%13)([c]1([cH]5[cH]6[cH]7[cH]81)[Si](C)(C)C)[c]1([Si](C)(C)C)[cH]9[cH]%10[cH]%11[cH]%121
• Title of publication: Lanthanide(III)/actinide(III) differentiation in coordination of azine molecules to tris(cyclopentadienyl) complexes of cerium and uranium.
• Authors of publication: Mehdoui, Thouraya; Berthet, Jean-Claude; Thuéry, Pierre; Ephritikhine, Michel
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 4
• Pages of publication: 579 - 590
• a: 11.4253 ± 0.001 Å
• b: 17.4702 ± 0.0018 Å
• c: 15.5095 ± 0.0015 Å
• α: 90°
• β: 90.699 ± 0.006°
• γ: 90°
• Cell volume: 3095.5 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1099
• Residual factor for significantly intense reflections: 0.0504
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No