Information card for entry 7041621

Structure parameters

• Formula: C10 H9 Cu N5 O7
• Calculated formula: C10 H7 Cu N5 O7
• Title of publication: Low temperature heat capacity, standard entropy, standard enthalpy and magnetic property: a new 1D Cu(II) coordination polymer incorporating tetrazole-1-acetic acid and p-nitrobenzoic acid.
• Authors of publication: Yang, Qi; Ge, Jing; Liu, Xin; Shi, Quan; Ke, Hongshan; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 6
• Pages of publication: 1878 - 1884
• a: 7.996 ± 0.002 Å
• b: 8.629 ± 0.002 Å
• c: 10.973 ± 0.003 Å
• α: 94.86 ± 0.005°
• β: 98.907 ± 0.005°
• γ: 101.907 ± 0.005°
• Cell volume: 726.5 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.101
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.1798
• Weighted residual factors for all reflections included in the refinement: 0.1991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No