Information card for entry 7016564

Structure parameters

• Common name: (12,14,16,52,54,56-Hexamethyl-1,5(1,3,5)-tribenzena- 3,7,10(1,3)-tri-benzimidazoliabicyclo(3.3.3)undecaphane -32,72- diylidene)-cooper(i) bis(perchlorate)
• Formula: C90 H86 Cl4 Cu2 N12 O16
• Calculated formula: C90 H86 Cl4 Cu2 N12 O16
• Title of publication: The solution stability of copper(i) and silver(i) complexes with N-heterocyclic carbenes.
• Authors of publication: Amendola, Valeria; Bergamaschi, Greta; Boiocchi, Massimo; Fabbrizzi, Luigi; Fusco, Nadia
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 33
• Pages of publication: 8367 - 8376
• a: 15.0018 ± 0.0014 Å
• b: 25.6183 ± 0.0012 Å
• c: 21.9405 ± 0.0012 Å
• α: 90°
• β: 97.797 ± 0.001°
• γ: 90°
• Cell volume: 8354.2 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0989
• Residual factor for significantly intense reflections: 0.0744
• Weighted residual factors for significantly intense reflections: 0.2214
• Weighted residual factors for all reflections included in the refinement: 0.2482
• 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: Yes
• Has Fobs: No