Information card for entry 2236955

Structure parameters

• Chemical name: (1-Acetylthiourea-κ<i>S</i>)bromidobis(triphenylphosphane-κ<i>P</i>)silver(I)
• Formula: C39 H36 Ag Br N2 O P2 S
• Calculated formula: C39 H36 Ag Br N2 O P2 S
• SMILES: C(N)(NC(=O)C)=[S][Ag]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)Br
• Title of publication: (1-Acetylthiourea-κ<i>S</i>)bromidobis(triphenylphosphane-κ<i>P</i>)silver(I)
• Authors of publication: Pakawatchai, Chaveng; Jantaramas, Piyapong; Mokhagul, Jedsada; Nimthong, Ruthairat
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 12
• Pages of publication: m1506 - m1507
• a: 10.4684 ± 0.0012 Å
• b: 12.9898 ± 0.0014 Å
• c: 14.8354 ± 0.0016 Å
• α: 71.091 ± 0.002°
• β: 80.955 ± 0.003°
• γ: 72.261 ± 0.002°
• Cell volume: 1813.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0693
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.0987
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes