Information card for entry 4333213

Structure parameters

• Formula: C16 H45 N6 Si2 Ta
• Calculated formula: C16 H45 N6 Si2 Ta
• SMILES: C[N]1(C)N([Si](C)(C)C)[Ta]21([N](C)(C)N2[Si](C)(C)C)(N(C)C)=NC(C)(C)C
• Title of publication: Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten
• Authors of publication: Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 6688 - 6701
• a: 10.2499 ± 0.0017 Å
• b: 16.1415 ± 0.0018 Å
• c: 16.683 ± 0.003 Å
• α: 90°
• β: 103.302 ± 0.019°
• γ: 90°
• Cell volume: 2686.1 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0813
• Weighted residual factors for all reflections included in the refinement: 0.0858
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No