Information card for entry 2239555

Structure parameters

• Chemical name: (Acetonitrile-κ<i>N</i>)iodidobis(triphenylphosphane-κ<i>P</i>)copper(I)
• Formula: C38 H33 Cu I N P2
• Calculated formula: C38 H33 Cu I N P2
• Title of publication: (Acetonitrile-κ<i>N</i>)iodidobis(triphenylphosphane-κ<i>P</i>)copper(I)
• Authors of publication: Wattanakanjana, Yupa; Nimthong, Arunpatcha; Mokakul, Jedsada; Sukpornsawan, Phattarin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 6
• Pages of publication: m219
• a: 9.2547 ± 0.0003 Å
• b: 19.3814 ± 0.0006 Å
• c: 19.4249 ± 0.0006 Å
• α: 90°
• β: 93.043 ± 0.001°
• γ: 90°
• Cell volume: 3479.31 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0813
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes