Information card for entry 1563424

Structure parameters

• Formula: C10 H8 Cu5 I5 N2 S2
• Calculated formula: C10 H8 Cu5 I5 N2 S2
• Title of publication: Dual graphs realized in the compounds di-μ3-4-mercaptopyridine catena-di-μ2-iodo-di-μ3-iodo-μ4-iodo penta copper(I) and di-μ3-4-mercaptopyridine-di-catena-iodo-di-μ3-iodo tri copper(I)
• Authors of publication: Jalilian, Ehsan; Lidin, Sven
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2010
• Journal volume: 183
• Journal issue: 11
• Pages of publication: 2656 - 2661
• a: 19.012 ± 0.0004 Å
• b: 19.012 ± 0.0004 Å
• c: 11.7253 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4238.18 ± 0.19 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :1
• Hall space group symbol: I 4bw -1bw
• Residual factor for all reflections: 0.0693
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0708
• Goodness-of-fit parameter for significantly intense reflections: 1.64
• Goodness-of-fit parameter for all reflections included in the refinement: 1.44
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes