Information card for entry 4080679

Structure parameters

• Common name: 2 in manuscript
• Formula: C36 H46 Au Cl3 N2 O3
• Calculated formula: C36 H46 Au Cl3 N2 O3
• Title of publication: Gold Phenolate Complexes: Synthesis, Structure, and Reactivity
• Authors of publication: Ibrahim, Nada; Vilhelmsen, Mie Højer; Pernpointner, Markus; Rominger, Frank; Hashmi, A. Stephen K.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 9
• Pages of publication: 2576
• a: 12.2263 ± 0.0001 Å
• b: 27.8242 ± 0.0004 Å
• c: 12.6285 ± 0.0002 Å
• α: 90°
• β: 116.606 ± 0.001°
• γ: 90°
• Cell volume: 3841.13 ± 0.09 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0708
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No