Information card for entry 7012537

Structure parameters

• Formula: C26 H14 Au2 F10 N P S
• Calculated formula: C26 H14 Au2 F10 N P S
• SMILES: [Au](c1c(c(c(c(c1F)F)F)F)F)[S]=C(NC)[P](c1ccccc1)(c1ccccc1)[Au](c1c(c(c(c(c1F)F)F)F)F)
• 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: 16.887 ± 0.0002 Å
• b: 12.669 ± 0.0002 Å
• c: 25.0874 ± 0.0003 Å
• α: 90°
• β: 92.2227 ± 0.0009°
• γ: 90°
• Cell volume: 5363.2 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0829
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.0957
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No