Information card for entry 2013825

Structure parameters

• Chemical name: Bis(N,N-di-n-butyldithiocarbamato-κ^2^S,S')(1,10-phenanthroline- κ^2^N,N')zinc(II) ethanol hemisolvate
• Formula: C31 H47 N4 O0.5 S4 Zn
• Calculated formula: C31 H47 N4 O0.5 S4 Zn
• Title of publication: Phenanthroline complexes of zinc and calcium carbamates
• Authors of publication: Reck, Günter; Becker, Roland
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 3
• Pages of publication: m134 - m136
• a: 10.006 ± 0.004 Å
• b: 13.347 ± 0.002 Å
• c: 15.531 ± 0.002 Å
• α: 103.71 ± 0.01°
• β: 102.78 ± 0.02°
• γ: 108.37 ± 0.02°
• Cell volume: 1811.2 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0465
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1464
• Weighted residual factors for all reflections included in the refinement: 0.1492
• Goodness-of-fit parameter for all reflections included in the refinement: 1.21
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes