Information card for entry 7713004

Structure parameters

• Chemical name: Au(IBiox-iPr)Cl
• Formula: C13 H20 Au Cl N2 O2
• Calculated formula: C13 H20 Au Cl N2 O2
• SMILES: [Au](Cl)=C1N2[C@H](COC2=C2OC[C@@H](N12)C(C)C)C(C)C
• Title of publication: Simple synthetic access to [Au(IBiox)Cl] complexes
• Authors of publication: Martynova, Ekaterina A.; Zuccarello, Marco; kronenberg, domenic; Belis, Marek; Cavallo, Luigi; Baudoin, Olivier; Kwit, Marcin; Van Hecke, Kristof; Zhang, Ziyun; czapik, agnieszka; Nolan, Steven P.
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 7.23112 ± 0.00015 Å
• b: 11.8487 ± 0.0003 Å
• c: 18.5359 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1588.14 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0925
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0412
• Weighted residual factors for all reflections included in the refinement: 0.0494
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No