Information card for entry 7006705

Structure parameters

• Common name: (Cu(PhOMeL2)).2MeOH
• Formula: C64 H78 Cu N4 O8
• Calculated formula: C64 H77 Cu N4 O8
• Title of publication: Phenoxyl radicals: H-bonded and coordinated to Cu(II) and Zn(II).
• Authors of publication: Benisvy, Laurent; Bill, Eckhard; Blake, Alexander J.; Collison, David; Davies, E. Stephen; Garner, C. David; McArdle, Graeme; McInnes, Eric J. L.; McMaster, Jonathan; Ross, Stephanie H. K.; Wilson, Claire
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 1
• Pages of publication: 258 - 267
• a: 12.9669 ± 0.0008 Å
• b: 13.2272 ± 0.0008 Å
• c: 18.4793 ± 0.0011 Å
• α: 102.802 ± 0.003°
• β: 98.699 ± 0.003°
• γ: 108.413 ± 0.003°
• Cell volume: 2847.4 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.189
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.127
• Weighted residual factors for all reflections included in the refinement: 0.173
• Goodness-of-fit parameter for all reflections included in the refinement: 0.946
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No