Information card for entry 4518912

Structure parameters

• Formula: C16 H18 Br2 Cu2 N4 O2
• Calculated formula: C16 H18 Br2 Cu2 N4 O2
• Title of publication: Single-Metallic Thermoresponsive Coordination Network as a Dual-Parametric Luminescent Thermometer
• Authors of publication: Thapa, Kedar Bahadur; Chen, Baojun; Bian, Li; Xu, Yixiu; He, Jiangang; Huang, Wei; Ju, Qiang; Fang, Zhenlan
• Journal of publication: ACS Applied Materials & Interfaces
• Year of publication: 2021
• a: 13.0548 ± 0.0018 Å
• b: 9.6339 ± 0.0012 Å
• c: 16.609 ± 0.002 Å
• α: 90°
• β: 107.692 ± 0.004°
• γ: 90°
• Cell volume: 1990.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1197
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1253
• Weighted residual factors for all reflections included in the refinement: 0.1487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No