Information card for entry 7012102

Structure parameters

• Formula: C106 H114.4 B4 Cu4 F16 N16 O19.2
• Calculated formula: C106 H104 B4 Cu4 F16 N16 O19.26
• Title of publication: Structures and properties of 6-aryl substituted tris(2-pyridylmethyl)amine transition metal complexes
• Authors of publication: He, Zhicong; Craig, Donald C.; Colbran, Stephen B.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 22
• Pages of publication: 4224
• a: 17.903 ± 0.018 Å
• b: 18.445 ± 0.015 Å
• c: 17.806 ± 0.028 Å
• α: 90°
• β: 91.71 ± 0.05°
• γ: 90°
• Cell volume: 5877 ± 12 ų
• Cell temperature: 294 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.71
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No