Information card for entry 4331863

Structure parameters

• Formula: C14 H18 Co N2 O6 S
• Calculated formula: C14 H18 Co N2 O6 S
• Title of publication: Boxes, Helicates, and Coordination Polymers: A Structural and Magnetochemical Investigation of the Diverse Coordination Chemistry of Simple Pyridine-Alcohol Ligands
• Authors of publication: Telfer, Shane G.; Kuroda, Reiko; Lefebvre, Julie; Leznoff, Daniel B.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 12
• Pages of publication: 4592 - 4601
• a: 8.4393 ± 0.0006 Å
• b: 8.5797 ± 0.0006 Å
• c: 12.0728 ± 0.0009 Å
• α: 81.842 ± 0.001°
• β: 84.06 ± 0.001°
• γ: 64.008 ± 0.001°
• Cell volume: 776.95 ± 0.1 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0312
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.0797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No