Information card for entry 1559717

Structure parameters

• Common name: mu-acetato-di-mu-hydroxo-mu-{N,N,N',N'-tetrakis(2-pyridylmethyl)-1,2- ethanediamine}dichromium-(III) perchlorate.
• Formula: C28 H33 Cl3 Cr2 N6 O16
• Calculated formula: C28 Cl3 Cr2 N6 O16
• SMILES: [Cr]12345[OH][Cr]67([OH]1)([O]=C(O2)C)[N](CC[N]3(Cc1[n]4cccc1)Cc1[n]5cccc1)(Cc1[n]6cccc1)Cc1[n]7cccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: Synthesis, Characterization and Structure of a New mu-Acetato-di-mu-hydroxo Bridged Chromium(III) Complex with a Sexidentate Binucleating Pyridylamine Ligand
• Authors of publication: Toftlund, Hans; Simonsen, Ole; Pedersen, Erik
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1990
• Journal volume: 44
• Pages of publication: 676 - 682
• a: 15.175 ± 0.003 Å
• b: 16.503 ± 0.003 Å
• c: 15.02 ± 0.003 Å
• α: 90°
• β: 97.39 ± 0.01°
• γ: 90°
• Cell volume: 3730.3 ± 1.3 ų
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.082
• Goodness-of-fit parameter for all reflections included in the refinement: 2.73
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No