Information card for entry 2013176

Structure parameters

• Chemical name: (O-ethyldithiocarbonato-κ^2^S,S')bis(triphenylphosphine-κP)silver(I)
• Formula: C39 H35 Ag O P2 S2
• Calculated formula: C39 H35 Ag O P2 S2
• SMILES: [Ag]1(SC(=[S]1)OCC)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: A new polymorph of (<i>O</i>-ethyl dithiocarbonato-κ^2^<i>S</i>,<i>S</i>')bis(triphenylphosphine-κ<i>P</i>)silver(I)
• Authors of publication: Ara, Irene; El Bahij, Fatima; Lachkar, Mohamed; Ben Larbi, Najib
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 3
• Pages of publication: m107 - m108
• a: 10.3302 ± 0.0006 Å
• b: 12.8582 ± 0.0007 Å
• c: 13.827 ± 0.0008 Å
• α: 87.432 ± 0.001°
• β: 74.956 ± 0.001°
• γ: 76.067 ± 0.001°
• Cell volume: 1721.17 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0654
• Weighted residual factors for all reflections included in the refinement: 0.0671
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes