Information card for entry 7026388

Structure parameters

• Formula: C42 H44 Cl2 Cu N6 O9
• Calculated formula: C42 H42 Cl2 Cu N6 O9
• Title of publication: Synthesis and characterization of enantiopure copper(II) complexes using chiral bidentate ligands.
• Authors of publication: Min, Kil Sik; Park, A. Hyun; Shin, Jong Won; Rowthu, Sankara Rao; Kim, Seog K.; Ryoo, Jae Jeong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 37
• Pages of publication: 8741 - 8747
• a: 13.1953 ± 0.0003 Å
• b: 13.1953 ± 0.0003 Å
• c: 50.6073 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8811.5 ± 0.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 96
• Hermann-Mauguin space group symbol: P 43 21 2
• Hall space group symbol: P 4nw 2abw
• Residual factor for all reflections: 0.1621
• Residual factor for significantly intense reflections: 0.0774
• Weighted residual factors for significantly intense reflections: 0.1803
• Weighted residual factors for all reflections included in the refinement: 0.2236
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No