Information card for entry 7052398

Structure parameters

• Formula: C39.75 H37.25 Cl3.75 Cu4 N14 O22.5
• Calculated formula: C39.75 H37.25 Cl3.75 Cu4 N14 O22.5
• Title of publication: Synthesis of pyridazinyl ligands for multimetallic complexes
• Authors of publication: Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder
• Journal of publication: New Journal of Chemistry
• Year of publication: 2006
• Journal volume: 30
• Journal issue: 10
• Pages of publication: 1498
• a: 10.403 ± 0.002 Å
• b: 16.763 ± 0.003 Å
• c: 17.194 ± 0.003 Å
• α: 80.373 ± 0.003°
• β: 82.56 ± 0.003°
• γ: 82.475 ± 0.003°
• Cell volume: 2912.9 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1106
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for significantly intense reflections: 0.1837
• Weighted residual factors for all reflections included in the refinement: 0.213
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.6768 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No