Information card for entry 7716087

Structure parameters

• Formula: C50 H76 Cl3 Co2 N11 O17
• Calculated formula: C46 H70 Cl3 Co2 N9 O17
• Title of publication: Increasing the electron donation in a dinucleating ligand family: molecular and electronic structures in a series of Co^IICo^II complexes.
• Authors of publication: Depenbrock, Felix; Limpke, Thomas; Stammler, Anja; Oldengott, Jan; Bögge, Hartmut; Glaser, Thorsten
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 22
• Pages of publication: 9554 - 9567
• a: 12.1162 ± 0.0016 Å
• b: 38.977 ± 0.005 Å
• c: 12.8849 ± 0.0016 Å
• α: 90°
• β: 93.902 ± 0.002°
• γ: 90°
• Cell volume: 6070.8 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0619
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No