Information card for entry 7102183

Structure parameters

• Formula: C56 H88 N4 O Si2 Zn2
• Calculated formula: C52 H80 N4 Si2 Zn2
• SMILES: [Zn]12[Zn](N([Si](N1c1c(C(C)C)cccc1C(C)C)(C)C)c1c(C(C)C)cccc1C(C)C)N([Si](N2c1c(C(C)C)cccc1C(C)C)(C)C)c1c(C(C)C)cccc1C(C)C
• Title of publication: Structural transformations in dinuclear zinc complexes involving Zn-Zn bonds.
• Authors of publication: Tsai, Yi-Chou; Lu, Duan-Yen; Lin, Yang-Miin; Hwang, Jenn-Kang; Yu, Jen-Shiang K
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 40
• Pages of publication: 4125 - 4127
• a: 13.1906 ± 0.0002 Å
• b: 20.2619 ± 0.0004 Å
• c: 21.1216 ± 0.0004 Å
• α: 86.141 ± 0.001°
• β: 76.328 ± 0.001°
• γ: 85.518 ± 0.001°
• Cell volume: 5461.42 ± 0.17 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0979
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1695
• Weighted residual factors for all reflections included in the refinement: 0.1856
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No