Information card for entry 7017036

Structure parameters

• Common name: Bis(pyridine-4-nitrile)bis(eta$1!-4-nitrobenzoato)cobalt(ii)
• Chemical name: Bis(pyridine-4-nitrile)bis(<i>η</i>^1^-4-nitrobenzoato)cobalt(II)
• Formula: C48 H50 Co2 N12 O17
• Calculated formula: C48 H50 Co2 N12 O17
• Title of publication: Novel C-HC contacts involving 3,5-dimethylpyrazole ligands in a tetracoordinate Co(ii) complex.
• Authors of publication: Chakravorty, Stutee; Platts, James A.; Das, Birinchi K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 43
• Pages of publication: 11605 - 11612
• a: 12.2261 ± 0.0005 Å
• b: 13.3635 ± 0.0005 Å
• c: 19.845 ± 0.0008 Å
• α: 103.477 ± 0.003°
• β: 90.516 ± 0.003°
• γ: 113.362 ± 0.002°
• Cell volume: 2875.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2804
• Residual factor for significantly intense reflections: 0.0854
• Weighted residual factors for significantly intense reflections: 0.1827
• Weighted residual factors for all reflections included in the refinement: 0.259
• Goodness-of-fit parameter for all reflections included in the refinement: 0.908
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No