Information card for entry 2209957

Structure parameters

• Chemical name: trans-Bis[(+)-(1R,4R)-3-benzoylcamphorato-κ^2^O,O']copper(II)
• Formula: C34 H38 Cu O4
• Calculated formula: C34 H38 Cu O4
• SMILES: [Cu]12(OC3=C([C@H]4CC[C@@]3(C4(C)C)C)C(=[O]1)c1ccccc1)OC1=C([C@H]3CC[C@@]1(C3(C)C)C)C(=[O]2)c1ccccc1
• Title of publication: <i>trans</i>-Bis[(+)-(1<i>R</i>,4<i>R</i>)-3-benzoylcamphorato-κ^2^<i>O</i>,<i>O</i>']copper(II)
• Authors of publication: Seo, Jang Woo; Niemeyer, Mark
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1863 - m1865
• a: 11.52 ± 0.002 Å
• b: 11.079 ± 0.002 Å
• c: 12.169 ± 0.002 Å
• α: 90°
• β: 115.12 ± 0.03°
• γ: 90°
• Cell volume: 1406.2 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.0946
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes