Information card for entry 4315590

Structure parameters

• Formula: C15 H20 Ag Br N4 O
• Calculated formula: C15 H20 Ag Br N4 O
• SMILES: [Ag](Br)=C1N(C=NN1CC(=O)NC(C)(C)C)Cc1ccccc1
• Title of publication: Highly Convenient Regioselective Intermolecular Hydroamination of Alkynes Yielding Ketimines Catalyzed by Gold(I) Complexes of 1,2,4-triazole Based N-heterocyclic Carbenes
• Authors of publication: Chandrakanta Dash; Mobin M. Shaikh; Ray J. Butcher; Prasenjit Ghosh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 4972 - 4983
• a: 8.0717 ± 0.0005 Å
• b: 9.2926 ± 0.0005 Å
• c: 12.8396 ± 0.0007 Å
• α: 90.178 ± 0.004°
• β: 92.364 ± 0.005°
• γ: 115.548 ± 0.005°
• Cell volume: 867.92 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.097
• Residual factor for significantly intense reflections: 0.0676
• Weighted residual factors for significantly intense reflections: 0.2098
• Weighted residual factors for all reflections included in the refinement: 0.2188
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No