Information card for entry 4339059

Structure parameters

• Formula: C3 H6 Br2 Cu2 N6
• Calculated formula: C3 H6 Br2 Cu2 N6
• Title of publication: New coordination motifs of melamine directed by N-H—X (X = Cl or Br) hydrogen bonds.
• Authors of publication: Zhang, Lei; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yin, Pei-Xiu; Yao, Yuan-Gen
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 15
• Pages of publication: 5838 - 5840
• a: 3.872 ± 0.003 Å
• b: 16.647 ± 0.01 Å
• c: 7.377 ± 0.005 Å
• α: 90°
• β: 99.074 ± 0.008°
• γ: 90°
• Cell volume: 469.5 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0661
• Weighted residual factors for all reflections included in the refinement: 0.0683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No