Information card for entry 2009217

Structure parameters

• Chemical name: copper(I) cyanide/morpholine 3/1
• Formula: C7 H9 Cu3 N4 S
• Calculated formula: C7 H9 Cu3 N4 S
• Title of publication: Copper(I) cyanide‒thiomorpholine (3/1)
• Authors of publication: Britton, Doyle; Stocker, Fred B.; Staeva, Teodora P.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 12
• Pages of publication: 2014 - 2016
• a: 16.161 ± 0.006 Å
• b: 9.262 ± 0.002 Å
• c: 7.133 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1067.7 ± 0.6 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0849
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for all reflections: 0.125
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections: 0.985
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No