Information card for entry 4085362

Structure parameters

• Formula: C41 H50 Au N O
• Calculated formula: C41 H50 Au N O
• SMILES: [Au](=C1N(c2c(C(C)C)cccc2C(C)C)C(C)(CC21C1CC3CC2CC(C3)C1)C)C(C(=O)c1ccccc1)c1ccccc1
• Title of publication: Gold(I) and Gold(III) Complexes of Cyclic (Alkyl)(amino)carbenes.
• Authors of publication: Romanov, Alexander S.; Bochmann, Manfred
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2439 - 2454
• a: 10.864 ± 0.002 Å
• b: 11.983 ± 0.003 Å
• c: 15.165 ± 0.004 Å
• α: 107.846 ± 0.005°
• β: 93.225 ± 0.005°
• γ: 99.554 ± 0.003°
• Cell volume: 1841.1 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.1068
• Weighted residual factors for all reflections included in the refinement: 0.1073
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No