Information card for entry 7214310

Structure parameters

• Formula: C32 H52 Cl2 Co2 N10 O11
• Calculated formula: C32 H52 Cl2 Co2 N10 O11
• Title of publication: Development and understanding of cobaloxime activity through electrochemical molecular catalyst screening.
• Authors of publication: Wakerley, David W.; Reisner, Erwin
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 12
• Pages of publication: 5739 - 5746
• a: 8 ± 0.0001 Å
• b: 13.5322 ± 0.0002 Å
• c: 19.2803 ± 0.0003 Å
• α: 90°
• β: 92.183 ± 0.001°
• γ: 90°
• Cell volume: 2085.72 ± 0.05 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No