Information card for entry 7252005

Structure parameters

• Chemical name: [Cu(pzca)2(Hpz)2]n
• Formula: C14 H14 Cu N8 O4
• Calculated formula: C14 H14 Cu N8 O4
• Title of publication: Two-and three-dimensional nickel(II) and copper(II) metal-organic frameworks based on 1H-pyrazole-4-carboxylate
• Authors of publication: Takeshi, Shin-ichiro; Lyu, Liangcheng; Hase, Akane; Haga, Nagito; Takano, Rina; Ishida, Takayuki; Kogane, Tamizo
• Journal of publication: CrystEngComm
• Year of publication: 2026
• a: 13.9954 ± 0.0006 Å
• b: 10.9431 ± 0.0004 Å
• c: 15.1529 ± 0.0007 Å
• α: 90°
• β: 110.706 ± 0.005°
• γ: 90°
• Cell volume: 2170.81 ± 0.17 ų
• Cell temperature: 298.8 ± 0.14 K
• Ambient diffraction temperature: 298.8 ± 0.14 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0478
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.1277
• Weighted residual factors for all reflections included in the refinement: 0.1319
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No