Information card for entry 4079163

Structure parameters

• Chemical name: Dimethylgoldtolylpyridine
• Formula: C14 H16 Au N
• Calculated formula: C14 H16 Au N
• SMILES: [Au]1(c2c(c3[n]1cccc3)ccc(c2)C)(C)C
• Title of publication: Versatile Methods for Preparation of New Cyclometalated Gold(III) Complexes
• Authors of publication: Langseth, Eirin; Görbitz, Carl Henrik; Heyn, Richard H.; Tilset, Mats
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 18
• Pages of publication: 6567
• a: 4.9545 ± 0.0003 Å
• b: 8.5064 ± 0.0005 Å
• c: 28.892 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1217.65 ± 0.13 ų
• Cell temperature: 105 ± 2 K
• Ambient diffraction temperature: 105 ± 2 K
• Number of distinct elements: 4
• 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: 0.0424
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0548
• Weighted residual factors for all reflections included in the refinement: 0.057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No