Information card for entry 4337629

Structure parameters

• Formula: C38 H36 Cu4 N8 O12 S4
• Calculated formula: C38 H36 Cu4 N8 O12 S4
• Title of publication: A versatile dinucleating ligand containing sulfonamide groups.
• Authors of publication: Sundberg, Jonas; Witt, Hannes; Cameron, Lisa; Håkansson, Mikael; Bendix, Jesper; McKenzie, Christine J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 6
• Pages of publication: 2873 - 2882
• a: 9.0921 ± 0.0006 Å
• b: 16.4521 ± 0.001 Å
• c: 14.1333 ± 0.0009 Å
• α: 90°
• β: 108.384 ± 0.003°
• γ: 90°
• Cell volume: 2006.2 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0256
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.0714
• Weighted residual factors for all reflections included in the refinement: 0.0741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No