Information card for entry 7012923

Structure parameters

• Formula: C26 H53 K O4 Zn3
• Calculated formula: C26 H53 K O4 Zn3
• SMILES: [Zn]12([O]3([Zn]4([O]5([Zn]3([O]1([K]5[O]24C(C)(C)C)C(C)(C)C)C)C(C)(C)C)C)C(C)(C)C)C.c1(ccccc1)C
• Title of publication: Facile synthesis and structural variation of novel heterobimetallic alkali metal?zinc-alkoxide and -siloxide clustersElectronic supplementary information (ESI) available: the ESI spectra of the reaction mixtures tBuOLi + ZnMe2, Me3SiOK + ZnMe2 and tBuOK + ZnMe2. See http://www.rsc.org/suppdata/dt/b3/b302585c/
• Authors of publication: Merz, Klaus; Block, Stefan; Schoenen, Robert; Driess, Matthias
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 17
• Pages of publication: 3365
• a: 10.748 ± 0.005 Å
• b: 13.214 ± 0.006 Å
• c: 23.706 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3367 ± 3 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• 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: 0.0918
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for significantly intense reflections: 0.1164
• Weighted residual factors for all reflections included in the refinement: 0.1259
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No