Information card for entry 7708761

Structure parameters

• Formula: C17 H17 Ag Cl N3
• Calculated formula: C17 H17 Ag Cl N3
• SMILES: [Ag](Cl)=C1N(C=CN1Cc1ncccc1)c1c(cccc1C)C
• Title of publication: One pot tandem dual CC and CO bond reductions in the β-alkylation of secondary alcohols with primary alcohols by ruthenium complexes of amido and picolyl functionalized N-heterocyclic carbenes.
• Authors of publication: Prakasham, A. P.; Ta, Sabyasachi; Dey, Shreyata; Ghosh, Prasenjit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 43
• Pages of publication: 15640 - 15654
• a: 9.8162 ± 0.0002 Å
• b: 16.0104 ± 0.0003 Å
• c: 10.8039 ± 0.0002 Å
• α: 90°
• β: 90.098 ± 0.002°
• γ: 90°
• Cell volume: 1697.95 ± 0.06 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0316
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.0605
• Weighted residual factors for all reflections included in the refinement: 0.0634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No