Information card for entry 4505670

Structure parameters

• Chemical name: tetra(acetonitrile) silver(I) cobalt(III) bis(dicarbollide) cyclotriveratrylene acetonitrile clathrate
• Formula: C39.5 H64.75 Ag B18 Co N4.25 O6
• Calculated formula: C39.5 H64 Ag B18 Co N4.25 O6
• Title of publication: Variable Ag(I) Coordination Modes in Silver Cobalt(III) Bis(dicarbollide) Supramolecular Assemblies with Cyclotriveratrylene Host Molecules
• Authors of publication: Ahmad, Ruksanna; Hardie, Michaele J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2003
• Journal volume: 3
• Journal issue: 4
• Pages of publication: 493
• a: 12.3042 ± 0.0001 Å
• b: 12.9172 ± 0.0001 Å
• c: 17.4093 ± 0.0002 Å
• α: 75.765 ± 0.001°
• β: 85.195 ± 0.001°
• γ: 85.813 ± 0.001°
• Cell volume: 2668.64 ± 0.04 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0891
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.142
• Weighted residual factors for all reflections included in the refinement: 0.1609
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No