Information card for entry 4517263

Structure parameters

• Formula: C36 H31 Cu2 N10 O13
• Calculated formula: C36 H31 Cu2 N10 O13
• Title of publication: Studies on Magnetic and Dielectric Properties of Antiferromagnetically Coupled Dinuclear Cu(II) in a One-Dimensional Cu(II) Coordination Polymer
• Authors of publication: Jana, Srikanta; Ray, Apurba; Chandra, Angeera; El Fallah, M. Salah; Das, Sachindranath; Sinha, Chittaranjan
• Journal of publication: ACS Omega
• Year of publication: 2019
• a: 15.485 ± 0.003 Å
• b: 20.386 ± 0.004 Å
• c: 12.655 ± 0.002 Å
• α: 90°
• β: 101.146 ± 0.005°
• γ: 90°
• Cell volume: 3919.5 ± 1.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 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: 0.0563
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.1265
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No