Information card for entry 4314066

Structure parameters

• Formula: C32 H24 Ag N5 O3
• Calculated formula: C32 H24 Ag N5 O3
• SMILES: c1c(c2ccccc2)nc(c[n]1[Ag][n]1cc(c2ccccc2)nc(c1)c1ccccc1)c1ccccc1.N(=O)(=O)[O-]
• Title of publication: Silver(I) Coordination Chemistry of 2,6-Diarylpyrazines. π-Stacking, Anion Coordination, and Steric Control
• Authors of publication: Nate Schultheiss; Douglas R. Powell; Eric Bosch
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5304 - 5310
• a: 7.1361 ± 0.0006 Å
• b: 30.91 ± 0.002 Å
• c: 11.9478 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2635.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0298
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.0926
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No