Information card for entry 4509454

Structure parameters

• Chemical name: trisbiimdazolecobalt(III) oxalate chloride hydrate
• Formula: C20 H29 Cl Co N12 O9.5
• Calculated formula: C20 H18 Cl Co N12 O9.5
• Title of publication: Oxalate- and Squarate-Biimidazole Supramolecular Synthons: Hydrogen-Bonded Networks Based on [Co(H2biimidazole)3]3+
• Authors of publication: Borel, Cédric; Larsson, Krister; Håkansson, Mikael; Olsson, Björn E.; Bond, Andrew D.; Öhrström, Lars
• Journal of publication: Crystal Growth & Design
• Year of publication: 2009
• Journal volume: 9
• Journal issue: 6
• Pages of publication: 2821
• a: 14.0103 ± 0.0008 Å
• b: 20.9727 ± 0.001 Å
• c: 21.3754 ± 0.0011 Å
• α: 90°
• β: 106.979 ± 0.003°
• γ: 90°
• Cell volume: 6007 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0801
• Residual factor for significantly intense reflections: 0.0715
• Weighted residual factors for significantly intense reflections: 0.1946
• Weighted residual factors for all reflections included in the refinement: 0.2061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.90703 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No