Information card for entry 7200760

Structure parameters

• Formula: C8 H15 Cu2 I2 N5
• Calculated formula: C8 H15 Cu2 I2 N5
• Title of publication: One-pot synthesis of two new copper(i) coordination polymers: in situ formation of different ligands from 4-aminotriazole
• Authors of publication: Zhao, Zhen-Guo; Yu, Rong-Min; Wu, Xiao-Yuan; Zhang, Qi-Sheng; Xie, Yi-Ming; Wang, Fei; Ng, Seik Weng; Lu, Can-Zhong
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 11
• Pages of publication: 2494
• a: 15.034 ± 0.004 Å
• b: 12.181 ± 0.003 Å
• c: 16.814 ± 0.004 Å
• α: 90°
• β: 102.133 ± 0.003°
• γ: 90°
• Cell volume: 3010.4 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0917
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No