Information card for entry 7031806

Structure parameters

• Formula: C98 H210 Cr6 N2 O46 P4 Tb2
• Calculated formula: C98.032 H208.072 Cr6 N2 O46.008 P4 Tb2
• Title of publication: Linking Cr3 triangles through phosphonates and lanthanides: synthetic, structural, magnetic and EPR studies.
• Authors of publication: Zangana, Karzan H.; Pineda, Eufemio Moreno; Vitorica-Yrezabal, Iñigo J; McInnes, Eric J. L.; Winpenny, Richard E. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 35
• Pages of publication: 13242 - 13249
• a: 13.9178 ± 0.0011 Å
• b: 14.0369 ± 0.0007 Å
• c: 23.3458 ± 0.0015 Å
• α: 99.776 ± 0.005°
• β: 101.128 ± 0.006°
• γ: 108.202 ± 0.005°
• Cell volume: 4119.7 ± 0.5 ų
• Cell temperature: 210.06 ± 0.16 K
• Ambient diffraction temperature: 210.06 ± 0.16 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0898
• Residual factor for significantly intense reflections: 0.0664
• Weighted residual factors for significantly intense reflections: 0.1828
• Weighted residual factors for all reflections included in the refinement: 0.2045
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No