Information card for entry 2007533

Structure parameters

• Chemical name: η-cyclopentadienyl-1,2,5,6-η-cyclooctatetraenecobalt'
• Formula: C13 H13 Co
• Calculated formula: C13 H13 Co
• SMILES: [Co]([cH]12)([cH]13)([cH]21)([cH]12)([cH]23)([cH]12)([cH]1cc3)([cH]31)[cH]1cc2
• Title of publication: [(1,2,5,6-η)-Cyclooctatetraene](η^5^-cyclopentadienyl)cobalt
• Authors of publication: Hubert Wadepohl; Rüdiger Merkel; Hans Pritzkow
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 1095 - 1097
• a: 12.302 ± 0.008 Å
• b: 7.461 ± 0.004 Å
• c: 11.203 ± 0.008 Å
• α: 90°
• β: 101.7 ± 0.05°
• γ: 90°
• Cell volume: 1006.9 ± 1.1 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 3
• 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: 0.0664
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for all reflections included in the refinement: 0.1042
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No