Information card for entry 7037474

Structure parameters

• Formula: C41 H32 Au Cl P4
• Calculated formula: C41 H32 Au Cl P4
• SMILES: Cl[Au][P](C1=CC2=P(P=P(C2=C1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: A zwitterionic triphosphenium compound as a tunable multifunctional donor.
• Authors of publication: Kosnik, Stephanie C.; Macdonald, Charles L. B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 6251 - 6258
• a: 13.5468 ± 0.0005 Å
• b: 16.8119 ± 0.0005 Å
• c: 16.3995 ± 0.0006 Å
• α: 90°
• β: 106.858 ± 0.001°
• γ: 90°
• Cell volume: 3574.4 ± 0.2 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: 0.03
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.0595
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No