Information card for entry 7713754

Structure parameters

• Formula: C7 H7 Cu N O6
• Calculated formula: C7 H7 Cu N O6
• Title of publication: Slow Magnetic Relaxation in a Ferromagnetic CuII Chain Complex, Induced by Phonon Bottleneck Effect
• Authors of publication: Sunkari, Sailaja S.; Verma, Abhineet; Pandey, Om; Gupta, Shraddha; Wakizaka, Masanori; Takaishi, Shinya; Kawasoko, Hideyuki; Fukumura, Tomoteru; Yamashita, Masahiro
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 7.1916 ± 0.0003 Å
• b: 18.8411 ± 0.0007 Å
• c: 6.4145 ± 0.0003 Å
• α: 90°
• β: 107.144 ± 0.005°
• γ: 90°
• Cell volume: 830.53 ± 0.06 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.0778
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No