Information card for entry 4089022

Structure parameters

• Formula: C15 H22 Au Cl5 N2 O
• Calculated formula: C15 H22 Au Cl5 N2 O
• SMILES: [Au](=C1ON(C(N1C(C)(C)C)c1ccc(C)cc1)C)(Cl)(Cl)Cl.ClCCl
• Title of publication: 1,3-Dipolar Cycloaddition of Nitrones to Gold(III)-Bound Isocyanides
• Authors of publication: Anisimova, Tatyana B.; Kinzhalov, Mikhail A.; Kuznetsov, Maxim L.; Guedes da Silva, M. Fátima C.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.; Pombeiro, Armando J. L.; Luzyanin, Konstantin V.
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 20
• Pages of publication: 3569
• a: 7.5167 ± 0.0004 Å
• b: 9.491 ± 0.0003 Å
• c: 15.2776 ± 0.0008 Å
• α: 101.664 ± 0.004°
• β: 98.71 ± 0.004°
• γ: 95.481 ± 0.004°
• Cell volume: 1046.11 ± 0.09 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0394
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0788
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No