Information card for entry 7239151

Structure parameters

• Formula: C8 H12 Cl Cu2 Er N6 O14
• Calculated formula: C8 H8 Cl Cu2 Er N6 O14
• Title of publication: A new family of 3d‒4f heterometallic coordination polymers assembled with 1H-1,2,3-triazole-4,5-dicarboxylic acid: syntheses, structures and magnetic properties
• Authors of publication: Zou, Ji-Yong; Xu, Na; Shi, Wei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 44
• Pages of publication: 21511
• a: 11.5842 ± 0.001 Å
• b: 6.772 ± 0.0006 Å
• c: 12.0905 ± 0.0015 Å
• α: 90°
• β: 103.604 ± 0.011°
• γ: 90°
• Cell volume: 921.87 ± 0.17 ų
• Cell temperature: 128.7 ± 0.14 K
• Ambient diffraction temperature: 128.7 ± 0.14 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/a 1
• Hall space group symbol: -P 2ya
• Residual factor for all reflections: 0.0638
• Residual factor for significantly intense reflections: 0.0624
• Weighted residual factors for significantly intense reflections: 0.1384
• Weighted residual factors for all reflections included in the refinement: 0.1392
• Goodness-of-fit parameter for all reflections included in the refinement: 1.208
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No