Information card for entry 4085361

Structure parameters

• Formula: C33 H40 Au F4 N
• Calculated formula: C33 H40 Au F4 N
• SMILES: c1(N2C(CC3(C4CC5CC3CC(C4)C5)C2=[Au]c2c(F)c(cc(c2F)F)F)(C)C)c(cccc1C(C)C)C(C)C
• 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: 14.5492 ± 0.0003 Å
• b: 14.4711 ± 0.0002 Å
• c: 15.3831 ± 0.0003 Å
• α: 90°
• β: 116.533 ± 0.002°
• γ: 90°
• Cell volume: 2897.68 ± 0.1 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0462
• Weighted residual factors for all reflections included in the refinement: 0.048
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No