Information card for entry 7702494

Structure parameters

• Common name: Complex 20
• Formula: C32 H58 N8 O27 S3 Zn3
• Calculated formula: C32 H44 N8 O27 S3 Zn3
• Title of publication: Copper complexes of the functionalised tripodal ligand tris(2-pyridyl)methylamine and its derivatives †
• Authors of publication: Arnold, Phillip J.; Davies, Sian C.; Dilworth, Jonathan R.; Durrant, Marcus C.; Griffiths, D. Vaughan; Hughes, David L.; Richards, Raymond L.; Sharpe, Philip C.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 5
• Pages of publication: 736
• a: 16.5362 ± 0.0015 Å
• b: 13.789 ± 0.002 Å
• c: 22.407 ± 0.002 Å
• α: 90°
• β: 111.652 ± 0.008°
• γ: 90°
• Cell volume: 4748.7 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for all reflections: 0.1154
• Weighted residual factors for significantly intense reflections: 0.1045
• Goodness-of-fit parameter for all reflections: 1.079
• Goodness-of-fit parameter for significantly intense reflections: 1.083
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No