Information card for entry 4107922

Structure parameters

• Formula: C46 H84 B Br Cl2 N2 P2 Pt Si
• Calculated formula: C46 H84 B Br Cl2 N2 P2 Pt Si
• SMILES: ClCCl.[Pt](B(N[Si](C)(C)C)Nc1ccccc1)([P](C1CCCCC1)(C1CCCCC1)C1CCCCC1)(Br)[P](C1CCCCC1)(C1CCCCC1)C1CCCCC1
• Title of publication: Synthesis and Reactivity Studies of Iminoboryl Complexes
• Authors of publication: Holger Braunschweig; Thomas Kupfer; Krzysztof Radacki; Achim Schneider; Fabian Seeler; Katharina Uttinger; Hongmei Wu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 7974 - 7983
• a: 14.0147 ± 0.0015 Å
• b: 21.578 ± 0.002 Å
• c: 16.6106 ± 0.0018 Å
• α: 90°
• β: 97.802 ± 0.006°
• γ: 90°
• Cell volume: 4976.7 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• 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: 0.0435
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0708
• Weighted residual factors for all reflections included in the refinement: 0.0803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No