Information card for entry 4120269

Structure parameters

• Chemical name: [(PPh3)Co(Medoen)Mg(Me3TACN)(THF)]BPh4
• Formula: C69 H88 B Co Mg N7 O4 P
• Calculated formula: C69 H88 B Co Mg N7 O4 P
• Title of publication: Selective Nitrite Reduction at Heterobimetallic CoMg Complexes
• Authors of publication: Christopher Uyeda; Jonas C. Peters
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 12023 - 12031
• a: 13.7524 ± 0.0008 Å
• b: 14.0032 ± 0.0008 Å
• c: 17.5215 ± 0.001 Å
• α: 103.512 ± 0.003°
• β: 99.587 ± 0.003°
• γ: 100.736 ± 0.003°
• Cell volume: 3144.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0813
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1167
• 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