Information card for entry 7028068

Structure parameters

• Formula: C8 H14 Cu2 N6 O5
• Calculated formula: C8 H14 Cu2 N6 O5
• Title of publication: Extended network via hydrogen bond linkages of zig-zag co-ordination chains [{Cu2(trans-oxen)(μ-OH)(μ-H2O)}n]n+ or [Cu2(trans-oxen)(μ-OCN)2]n [H2oxen = N,N′-bis(2-aminoethyl)oxamide]
• Authors of publication: Chen, Zhong-Ning; Zhang, Hua-Xin; Yu, Kai-Bei; Zheng, Kang-Cheng; Cai, Hu; Kang, Bei-Sheng
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 7
• Pages of publication: 1133
• a: 12.878 ± 0.001 Å
• b: 6.897 ± 0.001 Å
• c: 16.117 ± 0.001 Å
• α: 90°
• β: 107.67 ± 0.01°
• γ: 90°
• Cell volume: 1364 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0309
• Residual factor for significantly intense reflections: 0.0234
• Weighted residual factors for all reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.0582
• Goodness-of-fit parameter for all reflections: 1.018
• Goodness-of-fit parameter for significantly intense reflections: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No