Information card for entry 7011416

Structure parameters

• Formula: C62 H48.67 Cl4 Co5 N26 O0.33
• Calculated formula: C62 H48.67 Cl4 Co5 N26 O0.333333
• Title of publication: Linear pentacobalt complexes: synthesis, structures, and physical properties of neutral and one-electron oxidation compounds
• Authors of publication: Yeh, Chen-Yu; Chou, Chung-Hsien; Pan, Kun-Chih; Wang, Chih-Chieh; Lee, Gene-Hsiang; Su, Y. Oliver; Peng, Shie-Ming
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 13
• Pages of publication: 2670
• a: 40.3422 ± 0.0011 Å
• b: 40.3422 ± 0.0011 Å
• c: 21.0202 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 29626.9 ± 1.4 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0792
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1644
• Weighted residual factors for all reflections included in the refinement: 0.1861
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No