Information card for entry 7709269

Structure parameters

• Formula: C46 H55 Cu N2 Sn
• Calculated formula: C46 H55 Cu N2 Sn
• Title of publication: The structures of ring-expanded NHC supported copper(i) triphenylstannyls and their phenyl transfer reactivity towards heterocumulenes
• Authors of publication: Charman, Rex S. C.; Mahon, Mary F.; Lowe, John P.; Liptrot, David J.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 11.9889 ± 0.0003 Å
• b: 17.2083 ± 0.0004 Å
• c: 20.1914 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4165.66 ± 0.16 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0368
• Residual factor for significantly intense reflections: 0.0293
• Weighted residual factors for significantly intense reflections: 0.0646
• Weighted residual factors for all reflections included in the refinement: 0.0679
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No