Information card for entry 7012536

Structure parameters

• Formula: C28 H26 Au2 N2 P2 S2
• Calculated formula: C28 H26 Au2 N2 P2 S2
• SMILES: [P]1([Au]2S/C(=N\C)[P]([Au]2S/C1=N\C)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Coordination modes of diphenylphosphinothioformamide in its neutral and deprotonated forms at gold(i)
• Authors of publication: Crespo, Olga; Fernández, Eduardo J.; Jones, Peter G.; Laguna, Antonio; López-de-Luzuriaga, José M.; Monge, Miguel; Olmos, M. Elena; Pérez, Javier
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 6
• Pages of publication: 1076
• a: 23.576 ± 0.003 Å
• b: 7.0362 ± 0.001 Å
• c: 16.6857 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2767.9 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.0622
• Weighted residual factors for all reflections included in the refinement: 0.0652
• Goodness-of-fit parameter for all reflections included in the refinement: 0.906
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No