Information card for entry 4515999

Structure parameters

• Formula: C21 H30 Au B Cl P
• Calculated formula: C21 H30 Au B Cl P
• SMILES: Cl[Au][P](CB(c1ccccc1)c1ccccc1)(C(C)(C)C)C(C)(C)C
• Title of publication: Gold(I) Complexes of the Geminal Phosphinoborane <i>t</i>Bu₂PCH₂BPh₂.
• Authors of publication: Boom, Devin H. A.; Ehlers, Andreas W.; Nieger, Martin; Devillard, Marc; Bouhadir, Ghenwa; Bourissou, Didier; Slootweg, J. Chris
• Journal of publication: ACS omega
• Year of publication: 2018
• Journal volume: 3
• Journal issue: 4
• Pages of publication: 3945 - 3951
• a: 17.0948 ± 0.0003 Å
• b: 7.0396 ± 0.0001 Å
• c: 17.6526 ± 0.0003 Å
• α: 90°
• β: 91.814 ± 0.001°
• γ: 90°
• Cell volume: 2123.26 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0399
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0788
• Weighted residual factors for all reflections included in the refinement: 0.0824
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No