Information card for entry 4308449

Structure parameters

• Formula: C24 H44 N4 Si4 Zr
• Calculated formula: C24 H44 N4 Si4 Zr
• SMILES: c12ccccc2N([Zr]2(N1[Si](C)(C)C)N(c1ccccc1N2[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C
• Title of publication: Azide Addition To Give a Tetra-azazirconacycle Complex
• Authors of publication: Alan F. Heyduk; Karen J. Blackmore; Nicole A. Ketterer; Joseph W. Ziller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 468 - 470
• a: 15.362 ± 0.004 Å
• b: 14.093 ± 0.004 Å
• c: 14.677 ± 0.004 Å
• α: 90°
• β: 90.082 ± 0.004°
• γ: 90°
• Cell volume: 3177.5 ± 1.5 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.02
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0528
• Weighted residual factors for all reflections included in the refinement: 0.0534
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No