Information card for entry 7038044

Structure parameters

• Formula: C55 H56 Cl2 Co N5
• Calculated formula: C55 H56 Cl2 Co N5
• Title of publication: Monoanionic bis(carbene) pincer complexes featuring cobalt(I-III) oxidation states.
• Authors of publication: Ibrahim, Abdulrahman D.; Tokmic, Kenan; Brennan, Marshall R.; Kim, Dongyoung; Matson, Ellen M.; Nilges, Mark J.; Bertke, Jeffery A.; Fout, Alison R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 24
• Pages of publication: 9805 - 9811
• a: 14.7605 ± 0.0005 Å
• b: 17.6571 ± 0.0006 Å
• c: 17.8623 ± 0.0005 Å
• α: 90°
• β: 91.1198 ± 0.0013°
• γ: 90°
• Cell volume: 4654.5 ± 0.3 ų
• Cell temperature: 105 ± 2 K
• Ambient diffraction temperature: 104.86 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0586
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1416
• Weighted residual factors for all reflections included in the refinement: 0.1499
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No