Information card for entry 4327221

Structure parameters

• Formula: C63 H71 Cu F6 N7 O3 P
• Calculated formula: C55 H51 Cu F6 N7 O P
• Title of publication: Copper(I) Complexes of Tripodal Tris(imidazolyl) Ligands: Potential Mimics of the Cu(A) Site of Hydroxylase Enzymes
• Authors of publication: Lei Zhou; Douglas Powell; Kenneth M. Nicholas
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 2316 - 2321
• a: 13.42 ± 0.002 Å
• b: 15.024 ± 0.002 Å
• c: 16.47 ± 0.003 Å
• α: 89.324 ± 0.005°
• β: 69.714 ± 0.005°
• γ: 68.746 ± 0.005°
• Cell volume: 2878.1 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0534
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.121
• Weighted residual factors for all reflections included in the refinement: 0.1261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No