Information card for entry 4313833

Structure parameters

• Formula: C30 H45 Cl N6 Si3 U
• Calculated formula: C34 H45 Cl N6 O Si3 U
• SMILES: [U]12345(Cl)N(c6ccccc6)[Si]([N]16CC[N]2([Si](N5c1ccccc1)(C)C)CC[N]3([Si](N4c1ccccc1)(C)C)CC6)(C)C.C1CCCOCC1
• Title of publication: Triamidotriazacyclononane Complexes of Group 3 Metals. Synthesis and Crystal Structures
• Authors of publication: Bernardo Monteiro; Dmitrii Roitershtein; Humberto Ferreira; José R. Ascenso; Ana M. Martins; Ângela Domingos; Noémia Marques
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 4223 - 4231
• a: 13.267 ± 0.002 Å
• b: 16.472 ± 0.002 Å
• c: 17.285 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3777.4 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.117
• Residual factor for significantly intense reflections: 0.0671
• Weighted residual factors for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections included in the refinement: 0.1374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No