Information card for entry 7054293

Structure parameters

• Formula: C12 H8 Ag Cl N6 O4 S2
• Calculated formula: C12 H8 Ag Cl N6 O4 S2
• Title of publication: Supramolecular silver(i) coordination isomers of different dimensionalities assembled using a conformationally flexible multidentate oligo-α-sulfanylpyrazinyl ligand
• Authors of publication: Wang, Han; Yang, Jin; Mak, Thomas C. W.
• Journal of publication: New J. Chem.
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 10
• Pages of publication: 4690
• a: 7.4609 ± 0.0005 Å
• b: 13.3836 ± 0.001 Å
• c: 16.1104 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1608.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0548
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1104
• Weighted residual factors for all reflections included in the refinement: 0.1163
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No