Information card for entry 4329442

Structure parameters

• Chemical name: Tetra(n-butyl)ammonium bis(tryptcylthiolato)cuprate(I) diethyl ether solvate
• Formula: C60 H72 Cu N O S2
• Calculated formula: C60 H72 Cu N O S2
• Title of publication: Synthesis and Structures of Cuprous Triptycylthiolate Complexes
• Authors of publication: Skylar J. Ferrara; Joel T. Mague; James P. Donahue
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 6567 - 6576
• a: 11.511 ± 0.0007 Å
• b: 16.0819 ± 0.001 Å
• c: 16.7584 ± 0.0011 Å
• α: 100.892 ± 0.001°
• β: 105.633 ± 0.001°
• γ: 108.445 ± 0.001°
• Cell volume: 2703.4 ± 0.3 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: 0.0832
• Residual factor for significantly intense reflections: 0.0614
• Weighted residual factors for significantly intense reflections: 0.1828
• Weighted residual factors for all reflections included in the refinement: 0.1968
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No