Information card for entry 7032094

Structure parameters

• Formula: C19 H21 Ag Cl N3
• Calculated formula: C19 H21 Ag Cl N3
• SMILES: [Ag](Cl)=C1N(N=C(N1c1ccc(C)cc1)c1ccccc1)C(C)(C)C
• Title of publication: Non-covalent interactions in coinage metal complexes of 1,2,4-triazole-based N-heterocyclic carbenes.
• Authors of publication: Turek, Jan; Panov, Illia; Svec, Petr; Růžičková, Zdeňka; Růžička, Aleš
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 41
• Pages of publication: 15465 - 15474
• a: 8.945 ± 0.0003 Å
• b: 10.9861 ± 0.0007 Å
• c: 10.995 ± 0.0006 Å
• α: 62.599 ± 0.004°
• β: 72.338 ± 0.003°
• γ: 80.124 ± 0.003°
• Cell volume: 913.4 ± 0.09 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0342
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0896
• Weighted residual factors for all reflections included in the refinement: 0.0919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No