Information card for entry 7709465

Structure parameters

• Formula: C24 H36 Cl Cu N6 O7 S2
• Calculated formula: C24 H36 Cl Cu N6 O7 S2
• Title of publication: N,N′-Substituted thioureas and their metal complexes: syntheses, structures and electronic properties
• Authors of publication: Al-Riyahee, Ali A. A.; Horton, Peter N.; Coles, Simon J.; Berry, Colin; Horrocks, Paul D.; Pope, Simon J. A.; Amoroso, Angelo J.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.077 ± 0.0003 Å
• b: 17.2213 ± 0.0008 Å
• c: 19.5201 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3051.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1073
• Residual factor for significantly intense reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.1278
• Weighted residual factors for all reflections included in the refinement: 0.1439
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No