Information card for entry 4312307

Structure parameters

• Formula: C27 H33 Cl3 Co N3 O7
• Calculated formula: C27 H33 Cl3 Co N3 O7
• SMILES: c12ccc(cc1C(C)=[N]1CC[N]3=C(c4cc(ccc4OC[Co]13([n]1ccccc1)(O2)[OH2])C)C)C.[O-]Cl(=O)(=O)=O.C(Cl)Cl
• Title of publication: New β Cis Folded Organocobalt Derivatives with a Salen-Type Ligand
• Authors of publication: Renata Dreos; Giorgio Nardin; Lucio Randaccio; Patrizia Siega; Giovanni Tauzher; Višnja Vrdoljak
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 6805 - 6811
• a: 11.387 ± 0.004 Å
• b: 11.922 ± 0.004 Å
• c: 12.036 ± 0.004 Å
• α: 106.75 ± 0.02°
• β: 110.02 ± 0.02°
• γ: 82.16 ± 0.02°
• Cell volume: 1468.8 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0719
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1422
• Weighted residual factors for all reflections included in the refinement: 0.158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No