Information card for entry 4505667

Structure parameters

• Chemical name: bis(acetonitrile) silver(I) cobalt(III) bis(dicarbollide)
• Formula: C8 H26 Ag B18 Co N2
• Calculated formula: C8 H28 Ag B18 Co N2
• SMILES: [Ag]([N]#CC)[N]#CC.[Co]12345678([BH]9%10%11[BH]%12%131[BH]1%142[CH]2%153[CH]34%10[BH]4%10%15[BH]%15%142[BH]2%131[BH]19%12[BH]%1134[BH]%10%1521)[CH]123[CH]495[BH]5%106[BH]6%117[BH]781[BH]18%11[BH]%11%106[BH]645[BH]439[BH]271[BH]8%1164
• 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: 7.1475 ± 0.0002 Å
• b: 28.7276 ± 0.001 Å
• c: 10.7856 ± 0.0004 Å
• α: 90°
• β: 93.829 ± 0.002°
• γ: 90°
• Cell volume: 2209.67 ± 0.13 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0542
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No