Information card for entry 7707631

Structure parameters

• Formula: C36 H52 Br4 Cl8 Cu2 N12 O2
• Calculated formula: C36 H52 Br4 Cl8 Cu2 N12 O2
• Title of publication: On the metal-ligand bonding in dinuclear complexes with redox-active guanidine ligands.
• Authors of publication: Steuer, Lena; Kaifer, Elisabeth; Himmel, Hans-Jörg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 27
• Pages of publication: 9467 - 9482
• a: 9.8593 ± 0.0009 Å
• b: 11.7388 ± 0.001 Å
• c: 12.372 ± 0.0011 Å
• α: 70.057 ± 0.003°
• β: 78.366 ± 0.004°
• γ: 85.877 ± 0.003°
• Cell volume: 1318.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No