Information card for entry 4513361

Structure parameters

• Formula: C24 H40 Cu4 N10 O2 S4
• Calculated formula: C24 H40 Cu4 N10 O2 S4
• Title of publication: Antiferromagnetic Mixed-Valence Cu(I)‒Cu(II) Two-Dimensional Coordination Polymers Constructed by Double Oximato Bridged Cu(II) Dimers and CuISCN Based One-Dimensional Anionic Chains
• Authors of publication: Das, Lakshmi Kanta; Diaz, Carmen; Ghosh, Ashutosh
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 8
• Pages of publication: 3939
• a: 11.7972 ± 0.0006 Å
• b: 13.8115 ± 0.0007 Å
• c: 10.667 ± 0.0005 Å
• α: 90°
• β: 98.116 ± 0.002°
• γ: 90°
• Cell volume: 1720.64 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0507
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0961
• Weighted residual factors for all reflections included in the refinement: 0.1022
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No