Information card for entry 4313870

Structure parameters

• Common name: Co3(depa)4Cl2.0.5hexane
• Formula: C59 H71 Cl2 Co3 N12
• Calculated formula: C59 H64 Cl2 Co3 N12
• Title of publication: Increasing Solubility and Stability of Linear Tricobalt(II) Chains with depa (Diethyldipyridylamide) Ligands
• Authors of publication: John F. Berry; F. Albert Cotton; Tongbu Lu; Carlos A. Murillo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 4425 - 4430
• a: 19.1585 ± 0.0004 Å
• b: 19.1585 ± 0.0004 Å
• c: 15.9611 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5858.5 ± 0.3 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 118
• Hermann-Mauguin space group symbol: P -4 n 2
• Hall space group symbol: P -4 -2n
• Residual factor for all reflections: 0.0629
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1054
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No