Information card for entry 7047448

Structure parameters

• Formula: C8.84 H8.14 Cd0.18 N0.91 O1.96
• Calculated formula: C8.84211 H8.14035 Cd0.175439 N0.912281 O1.96491
• Title of publication: Homochiral coordination polymers constructed from V-shaped oxybisbenzoyl-based amino acid derivatives: structures, magnetic and photoluminescence properties.
• Authors of publication: Guan, Guo-Xiu; Guo, Wei-Xiao; Liu, Xu; Yue, Qi; Gao, En-Qing
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 39
• Pages of publication: 13990 - 14000
• a: 42.4758 ± 0.0009 Å
• b: 13.9687 ± 0.0003 Å
• c: 23.1291 ± 0.0006 Å
• α: 90°
• β: 105.61 ± 0.003°
• γ: 90°
• Cell volume: 13217.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1066
• Residual factor for significantly intense reflections: 0.0922
• Weighted residual factors for significantly intense reflections: 0.2483
• Weighted residual factors for all reflections included in the refinement: 0.2636
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No