Information card for entry 2010588

Structure parameters

• Common name: (-)-sparteine copper(II) diacetate
• Chemical name: {1,3,4,7,7a,8,9,10,11,13,14,14a-dodecahydro-7,14-methano- 2H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocine-N,N'}bis(acetato- O,O')copper(II)
• Formula: C19 H32 Cu N2 O4
• Calculated formula: C19 H32 Cu N2 O4
• SMILES: [Cu]1([N]23CCCC[C@@H]2[C@@H]2C[N]41CCCC[C@H]4[C@H](C3)C2)(OC(=O)C)OC(=O)C
• Title of publication: ({-})-Sparteine copper(II) diacetate
• Authors of publication: Lee, Yong-Min; Chung, Geewon; Kwon, Mi-A; Choi, Sung-Nak
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 1
• Pages of publication: 67 - 68
• a: 8.0507 ± 0.0008 Å
• b: 12.0791 ± 0.0012 Å
• c: 10.2946 ± 0.0008 Å
• α: 90°
• β: 97.954 ± 0.008°
• γ: 90°
• Cell volume: 991.47 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.315
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No