Information card for entry 7049547

Structure parameters

• Formula: C55.62 H70 Cl2 F6 N10 O20.38 P2 Tb4
• Calculated formula: C55.62 H70 Cl2 F6 N10 O20.38 P2 Tb4
• Title of publication: Phosphonate-assisted tetranuclear lanthanide assemblies: observation of the toroidic ground state in the Tb^III analogue.
• Authors of publication: Biswas, Sourav; Kumar, Pawan; Swain, Abinash; Gupta, Tulika; Kalita, Pankaj; Kundu, Subrata; Rajaraman, Gopalan; Chandrasekhar, Vadapalli
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 19
• Pages of publication: 6421 - 6434
• a: 12.2855 ± 0.0005 Å
• b: 12.86 ± 0.0005 Å
• c: 14.6338 ± 0.0006 Å
• α: 112.561 ± 0.001°
• β: 99.355 ± 0.001°
• γ: 108.988 ± 0.001°
• Cell volume: 1906.44 ± 0.14 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0433
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0703
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No