Information card for entry 7011935

Structure parameters

• Formula: C8 H21 Cl5 Co N5 O Zn
• Calculated formula: C8 H21 Cl5 Co N5 O Zn
• SMILES: [Zn](Cl)(Cl)([Cl-])[Cl-].[Co]123([NH2]CC[N]1=C(C(=[N]2O)C)C)([NH2]CC[NH2]3)Cl
• Title of publication: Polydentate ligand construction: preparation of oxime???imine complexes via intramolecular condensation reactions
• Authors of publication: Otter, Carl A.; Hartshorn, Richard M.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 22
• Pages of publication: 4193
• a: 16.375 ± 0.003 Å
• b: 8.379 ± 0.0017 Å
• c: 13.418 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1841 ± 0.7 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0176
• Residual factor for significantly intense reflections: 0.0173
• Weighted residual factors for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.0441
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No