Information card for entry 2214702

Structure parameters

• Chemical name: Bis[μ-bis(diphenylphosphino)methane-κ^2^P:P']digold(I)(Au—Au) dinitrate perdeuteromethanol solvate
• Formula: C52 H44 Au2 D8 N2 O8 P4
• Calculated formula: C52 H44 Au2 D8 N2 O8 P4
• SMILES: C(O[2H])([2H])([2H])[2H].N(=O)(=O)[O-].[Au]([P](C[P]([Au]1)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)[P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.C(O[2H])([2H])([2H])[2H].N(=O)(=O)[O-]
• Title of publication: Bis[μ-bis(diphenylphosphino)methane-κ^2^<i>P</i>:<i>P</i>']digold(I)(<i>Au{—</i>Au}) dinitrate perdeuteromethanol solvate
• Authors of publication: Leigh-Anne de Jongh; Christoph E. Strasser; Stephanie Cronje; Helgard G. Raubenheimer
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m2137 - m2138
• a: 11.6214 ± 0.0008 Å
• b: 13.6313 ± 0.0009 Å
• c: 16.4319 ± 0.0012 Å
• α: 90°
• β: 109.048 ± 0.001°
• γ: 90°
• Cell volume: 2460.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0248
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.0507
• Weighted residual factors for all reflections included in the refinement: 0.0518
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes