Information card for entry 4321750

Structure parameters

• Formula: C32 H88 Cl2 Mo2 N12 O0.5 Si6 Zr
• Calculated formula: C32 H80.588 Cl2 Mo2 N12 O0.5 Si6 Zr
• Title of publication: Heterobimetallic Dinitrogen Complexes That Contain the {[N3N]Mo-NN}- Ligand
• Authors of publication: Myra B. O'Donoghue; William M. Davis; Richard R. Schrock; William M. Reiff
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 243 - 252
• a: 16.415 ± 0.0003 Å
• b: 18.5686 ± 0.0004 Å
• c: 19.8964 ± 0.0004 Å
• α: 90°
• β: 100.259 ± 0.001°
• γ: 90°
• Cell volume: 5967.5 ± 0.2 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0986
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for all reflections: 0.1835
• Weighted residual factors for significantly intense reflections: 0.1322
• Goodness-of-fit parameter for all reflections: 1.056
• Goodness-of-fit parameter for significantly intense reflections: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No