Information card for entry 7001004

Structure parameters

• Formula: C48 H42 F12 N4 P4 Tl2
• Calculated formula: C48 H42 F12 N4 P4 Tl2
• Title of publication: Mono-, di- and polymetallic TlI complexes stabilized by a 2,5-bis(2-pyridyl)-1-phenyl-phosphole ligand
• Authors of publication: Welsch, Stefan; Lescop, Christophe; Réau, Régis; Scheer, Manfred
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 15
• Pages of publication: 2683 - 2686
• a: 10.8581 ± 0.0002 Å
• b: 12.5163 ± 0.0002 Å
• c: 18.3704 ± 0.0003 Å
• α: 91.335 ± 0.002°
• β: 91.937 ± 0.002°
• γ: 102.785 ± 0.002°
• Cell volume: 2432.09 ± 0.07 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 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: 0.0394
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.0963
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No