Information card for entry 4319901

Structure parameters

• Common name: [Co(TPP)(1-BuNH2)2]SbF6
• Chemical name: bis(1-butylamine)(5,10,15,20-mesotetraphenylporphinato)cobalt(III) hexafluoroantimonate(V)
• Formula: C52 H50 Co F6 N6 Sb
• Calculated formula: C52 H50 Co F6 N6 Sb
• Title of publication: Structural, Computational, and 59Co NMR Studies of Primary and Secondary Amine Complexes of Co(III) Porphyrins
• Authors of publication: Orde Q. Munro; Sibongiseni C. Shabalala; Nicola J. Brown
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 3303 - 3317
• a: 16.2614 ± 0.0009 Å
• b: 12.7546 ± 0.0007 Å
• c: 23.2873 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4830 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0867
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.182
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No