Information card for entry 4334951

Structure parameters

• Formula: C16 H15 Ag Cl N3
• Calculated formula: C16 H15 Ag Cl N3
• SMILES: [Ag](Cl)=C1N(N(N=C1c1ccc(cc1)C)c1ccccc1)C
• Title of publication: Exploring the Scope of a Novel Ligand Class: Synthesis and Catalytic Examination of Metal Complexes with 'Normal' 1,2,3-Triazolylidene Ligands
• Authors of publication: Lars-Arne Schaper; Lilian Graser; Xuhui Wei; Rui Zhong; Karl Öfele; Alexander Pöthig; Mirza Cokoja; Bettina Bechlars; Wolfgang A. Herrmann; Fritz E. Kühn
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 6142 - 6152
• a: 5.9205 ± 0.0002 Å
• b: 12.1256 ± 0.0006 Å
• c: 12.4065 ± 0.0006 Å
• α: 115.183 ± 0.002°
• β: 101.493 ± 0.002°
• γ: 90.792 ± 0.002°
• Cell volume: 784.94 ± 0.06 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0528
• Weighted residual factors for all reflections included in the refinement: 0.0582
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No