Information card for entry 4315049

Structure parameters

• Common name: [Co(TpivPP)(2-MeIm)]2EtOH
• Formula: C72 H82 Co N10 O6
• Calculated formula: C72 H70 Co N10 O6
• Title of publication: Oxygenation of Cobalt Porphyrinates: Coordination or Oxidation?
• Authors of publication: Jianfeng Li; Bruce C. Noll; Allen G. Oliver; Guillermo Ferraudi; A. Graham Lappin; W. Robert Scheidt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2398 - 2406
• a: 18.5616 ± 0.0007 Å
• b: 19.654 ± 0.0007 Å
• c: 17.8515 ± 0.0006 Å
• α: 90°
• β: 90.834 ± 0.001°
• γ: 90°
• Cell volume: 6511.7 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0539
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1292
• Weighted residual factors for all reflections included in the refinement: 0.14
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No