Information card for entry 4064049

Structure parameters

• Formula: C21 H45 N3 O3 Zn3
• Calculated formula: C21 H45 N3 O3 Zn3
• SMILES: [Zn]12([O]([Zn]3([O]([Zn]4([O]1C(=[N]4C(C)(C)C)C)C)C(=[N]3C(C)(C)C)C)C)C(=[N]2C(C)(C)C)C)C
• Title of publication: Insertion Reactions of Heterocumulenes into Zn−C Bonds: Synthesis and Structural Characterization of Multinuclear Zinc Amidate Complexes
• Authors of publication: Schmidt, Sarah; Schäper, Raphaela; Schulz, Stephan; Bläser, Dieter; Wölper, Christoph
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 5
• Pages of publication: 1073
• a: 9.0753 ± 0.0004 Å
• b: 12.382 ± 0.0005 Å
• c: 14.3193 ± 0.0006 Å
• α: 75.062 ± 0.002°
• β: 76.264 ± 0.002°
• γ: 71.623 ± 0.002°
• Cell volume: 1453.84 ± 0.11 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0696
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No