Information card for entry 7006488

Structure parameters

• Formula: C24 H29 N11 O10.5 Pr
• Calculated formula: C24 H26 N11 O10.5 Pr
• Title of publication: Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).
• Authors of publication: Foreman, Mark R. S.; Hudson, Michael J.; Drew, Michael G. B.; Hill, Clément; Madic, Charles
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 13
• Pages of publication: 1645 - 1653
• a: 8.809 ± 0.009 Å
• b: 11.928 ± 0.013 Å
• c: 15.846 ± 0.018 Å
• α: 90°
• β: 99.983 ± 0.01°
• γ: 90°
• Cell volume: 1640 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0381
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for all reflections: 0.0938
• Weighted residual factors for significantly intense reflections: 0.0928
• Goodness-of-fit parameter for all reflections: 1.182
• Goodness-of-fit parameter for significantly intense reflections: 1.193
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No