Information card for entry 2312480

Structure parameters

• Chemical name: Poly[bis(2-aminoethanol)tetra-μ-cyanido-tricopper(II)]
• Formula: C8 H14 Cu3 N6 O2
• Calculated formula: C8 H14 Cu3 N6 O2
• Title of publication: Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers.
• Authors of publication: Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 6
• a: 9.5158 ± 0.0002 Å
• b: 8.8022 ± 0.0002 Å
• c: 9.3589 ± 0.0002 Å
• α: 90°
• β: 117.358 ± 0.001°
• γ: 90°
• Cell volume: 696.22 ± 0.03 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.057
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0541
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.156
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No