Information card for entry 7717211

Structure parameters

• Chemical name: Co1
• Formula: C27 H34 Co N9 O8.5
• Calculated formula: C27 H34 Co N9 O8.5
• Title of publication: Not So Inert Mer-Tris-Chelate Cobalt(III) Complex of Hydroxy-pyridine Functionalized NHC Ligand for Cyclic Carbonates Synthesis
• Authors of publication: Chowdhury, Rhitwika; Bhat, Irshad Ahmad; Sachan, Sharad Kumar; Anantharaman, Ganapathi
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 8.515 ± 0.0006 Å
• b: 17.8418 ± 0.0012 Å
• c: 19.7536 ± 0.0014 Å
• α: 90°
• β: 96.895 ± 0.002°
• γ: 90°
• Cell volume: 2979.3 ± 0.4 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 5
• 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: 0.1351
• Residual factor for significantly intense reflections: 0.0718
• Weighted residual factors for significantly intense reflections: 0.1377
• Weighted residual factors for all reflections included in the refinement: 0.1592
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No