Information card for entry 4076281

Structure parameters

• Formula: C33 H39 Cu N2
• Calculated formula: C33 H39 Cu N2
• Title of publication: Synthesis, Structure, and CO2Reactivity of a Two-Coordinate (Carbene)copper(I) Methyl Complex
• Authors of publication: Mankad, Neal P.; Gray, Thomas G.; Laitar, David S.; Sadighi, Joseph P.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 6
• Pages of publication: 1191
• a: 22.561 ± 0.003 Å
• b: 9.4266 ± 0.0012 Å
• c: 16.89 ± 0.002 Å
• α: 90°
• β: 116.117 ± 0.002°
• γ: 90°
• Cell volume: 3225.3 ± 0.7 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1378
• Residual factor for significantly intense reflections: 0.0869
• Weighted residual factors for significantly intense reflections: 0.1758
• Weighted residual factors for all reflections included in the refinement: 0.1935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.158
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No