Information card for entry 7016683

Structure parameters

• Formula: C27 H31.7 Cl2 Co N5 O10.15
• Calculated formula: C27 H31.7 Cl2 Co N5 O10.15
• Title of publication: Switching on oxygen activation by cobalt complexes of pentadentate ligands.
• Authors of publication: Vad, Mads S.; Nielsen, Anne; Lennartson, Anders; Bond, Andrew D.; McGrady, John E.; McKenzie, Christine J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 40
• Pages of publication: 10698 - 10707
• a: 8.6824 ± 0.0005 Å
• b: 11.6313 ± 0.0007 Å
• c: 15.8043 ± 0.0009 Å
• α: 76.45 ± 0.003°
• β: 87.333 ± 0.003°
• γ: 69.1 ± 0.002°
• Cell volume: 1448.32 ± 0.15 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0326
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0678
• Weighted residual factors for all reflections included in the refinement: 0.0704
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No