Information card for entry 7245116

Structure parameters

• Formula: C16 H18 Cl2 Cu2 N4 O2
• Calculated formula: C16 H18 Cl2 Cu2 N4 O2
• Title of publication: Coordination networks constructed from a flexible ligand: single-crystal-to-single-crystal transformations, thermoresponsive and electrochemical performances
• Authors of publication: Zhu, Jinjiao; Sun, Yajun; Ding, Weilinsen; Li, Peiyuan; Pang, Qingyang; Dou, Xinwen; Bian, Li; Ju, Qiang; Fang, Zhenlan
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 12.892 ± 0.017 Å
• b: 9.895 ± 0.013 Å
• c: 17.43 ± 0.02 Å
• α: 90 ± 0.04°
• β: 105.86 ± 0.03°
• γ: 90 ± 0.04°
• Cell volume: 2139 ± 5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0863
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1393
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No