Information card for entry 7103383

Structure parameters

• Formula: C29 H42 Cl5 Cu N2
• Calculated formula: C29 H42 Cl5 Cu N2
• Title of publication: A [(NHC)CuCl] complex as a latent Click catalyst.
• Authors of publication: Díez-González, Silvia; Stevens, Edwin D; Nolan, Steven P
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 39
• Pages of publication: 4747 - 4749
• a: 9.5227 ± 0.0011 Å
• b: 16.4203 ± 0.0019 Å
• c: 11.0548 ± 0.0013 Å
• α: 90°
• β: 103.81 ± 0.002°
• γ: 90°
• Cell volume: 1678.6 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0775
• Weighted residual factors for all reflections included in the refinement: 0.0801
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No