Information card for entry 7004654

Structure parameters

• Formula: C8 H11 As B Br2 N O5 W
• Calculated formula: C8 H11 As B Br2 N O5 W
• SMILES: [W]([As](Br)(Br)[BH2][N](C)(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Selective halogenation at the pnictogen atom in Lewis-acid/base-stabilised phosphanylboranes and arsanylboranes
• Authors of publication: Schwan, Karl-Christian; Adolf, Ariane; Thoms, Christine; Zabel, Manfred; Timoshkin, Alexey Y.; Scheer, Manfred
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 37
• Pages of publication: 5054 - 5058
• a: 9.0879 ± 0.0003 Å
• b: 12.1395 ± 0.0006 Å
• c: 14.9688 ± 0.0006 Å
• α: 84.206 ± 0.004°
• β: 89.154 ± 0.003°
• γ: 75.918 ± 0.003°
• Cell volume: 1593.5 ± 0.12 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0468
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.1001
• Weighted residual factors for all reflections included in the refinement: 0.1051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No