Information card for entry 7022995

Structure parameters

• Common name: bis(mu!3$-1,2-dithiolatoethane-S,S,S',S')-di(butan-1-ido) - tris(triisopropylphosphine)-tricopper(+1)-gallium(+3)
• Chemical name: bis(μ~3~-1,2-dithiolatoethane-S,S,S',S')-di(butan-1-ido) -tris(triisopropylphosphine)-tricopper(+1)-gallium(+3)
• Formula: C39 H89 Cu3 Ga P3 S4
• Calculated formula: C39 H89 Cu3 Ga P3 S4
• Title of publication: Tetranuclear organometallic complexes based on 1,2-ethanedithiolate ligands as potential precursors for CuMS2 (M = Ga, In).
• Authors of publication: Friedrich, Dirk; Kluge, Oliver; Kischel, Marcus; Krautscheid, Harald
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 26
• Pages of publication: 9613 - 9620
• a: 15.7297 ± 0.0007 Å
• b: 26.1766 ± 0.0018 Å
• c: 25.2306 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10388.7 ± 1 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0548
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0692
• Weighted residual factors for all reflections included in the refinement: 0.0735
• Goodness-of-fit parameter for all reflections included in the refinement: 0.872
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No