Information card for entry 4303049

Structure parameters

• Formula: C40 H36 Ag2 B2 F8 N12
• Calculated formula: C40 H36 Ag2 B2 F8 N12
• SMILES: [Ag]([n]1cccn1c1cccc2cccc(c12)n1ccc[n]1[Ag]1[N]#CC)([n]2cccn2c2cccc3cccc(c23)n2ccc[n]12)([N]#CC)[N]#CC.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-].C(#N)C
• Title of publication: Manipulating Self-Assembly in Silver(I) Complexes of 1,3-Di-N-pyrazolylorganyls
• Authors of publication: Brendan J. Liddle; Daniel Hall; Sergey V. Lindeman; Mark D. Smith; James R. Gardinier
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 8404 - 8414
• a: 20.7036 ± 0.0013 Å
• b: 14.4179 ± 0.0009 Å
• c: 14.6464 ± 0.0009 Å
• α: 90°
• β: 93.594 ± 0.001°
• γ: 90°
• Cell volume: 4363.4 ± 0.5 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0348
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0815
• Weighted residual factors for all reflections included in the refinement: 0.0836
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No