Information card for entry 4304696

Structure parameters

• Formula: C29 H35 Au N O4 P S2
• Calculated formula: C29 H35 Au N O4 P S2
• SMILES: [Au]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)SC(=[S]1)N1CCOCCOCCOCCOCC1
• Title of publication: Mononuclear, Dinuclear, and Hexanuclear Gold(I) Complexes with (aza-15-crown-5)Dithiocarbamate
• Authors of publication: Javier Arias; Manuel Bardají; Pablo Espinet
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 1597 - 1606
• a: 8.877 ± 0.009 Å
• b: 9.245 ± 0.009 Å
• c: 19.55 ± 0.02 Å
• α: 76.475 ± 0.016°
• β: 78.053 ± 0.016°
• γ: 81.773 ± 0.017°
• Cell volume: 1519 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0734
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.1717
• Weighted residual factors for all reflections included in the refinement: 0.1803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No