Information card for entry 4504215

Structure parameters

• Chemical name: [tri(2,3-bis(2-pyridyl)pyrazine)disilver(I)](1-(4-bromophenyl)-closo-1-monocarbadodecaborane) acetonitrile clathrate
• Formula: C58 H63 Ag2 B22 Br2 N13
• Calculated formula: C58 H63 Ag2 B22 Br2 N13
• Title of publication: One-Dimensional Coordination Polymers with Phenyl-carbaborane Anions: Ag(I)/4,4‘-Bipyridine and 2,3-Bis-(2-pyridyl)pyrazine Complexes
• Authors of publication: Cunha-Silva, Luís; Ahmad, Ruksanna; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Hardie, Michaele J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 4
• Pages of publication: 658
• a: 12.2071 ± 0.0001 Å
• b: 12.8065 ± 0.0001 Å
• c: 23.8761 ± 0.0003 Å
• α: 98.978 ± 0.001°
• β: 92.003 ± 0.001°
• γ: 106.649 ± 0.001°
• Cell volume: 3519.73 ± 0.06 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0958
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.1441
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No