Information card for entry 7716159

Structure parameters

• Chemical name: DB-630
• Formula: C30 H28 B Cl4 N2 O5 P W
• Calculated formula: C30 H28 B Cl4 N2 O5 P W
• SMILES: [W]([P](n1c[n+](cc1)C)(C(c1ccccc1)(c1ccccc1)c1ccccc1)[BH3])(C#[O])(C#[O])(C#[O])(C#[O])C#[O].ClCCl.ClCCl
• Title of publication: A metal and a metalloid Lewis acid bridged by a μ₂-phosphinidene.
• Authors of publication: Biskup, David; Schnakenburg, Gregor; Espinosa Ferao, Arturo; Streubel, Rainer
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 23
• Pages of publication: 9670 - 9674
• a: 11.0075 ± 0.0006 Å
• b: 12.333 ± 0.0007 Å
• c: 12.9754 ± 0.0007 Å
• α: 85.521 ± 0.002°
• β: 73.945 ± 0.002°
• γ: 81.084 ± 0.002°
• Cell volume: 1671.17 ± 0.16 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0219
• Residual factor for significantly intense reflections: 0.0199
• Weighted residual factors for significantly intense reflections: 0.0471
• Weighted residual factors for all reflections included in the refinement: 0.0483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No