Information card for entry 7209727

Structure parameters

• Formula: C11 H15 Cu N O6
• Calculated formula: C11 H15 Cu N O6
• Title of publication: Chirality and absolute helicity in a pair of enantiomeric amino acid derivatives and their complexes: structures, chiroptical, and photoluminescent properties
• Authors of publication: Li, Xinfa; Zhao, Huajun; Zeng, Qihua
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 18
• Pages of publication: 3593
• a: 7.5385 ± 0.00001 Å
• b: 7.5385 ± 0.00001 Å
• c: 22.7308 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1291.77 ± 0.006 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 76
• Hermann-Mauguin space group symbol: P 41
• Hall space group symbol: P 4w
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0632
• Weighted residual factors for all reflections included in the refinement: 0.0649
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No