Information card for entry 7031808

Structure parameters

• Formula: C98 H210 Cr6 Ho2 N2 O46 P4
• Calculated formula: C98.024 H208.054 Cr6 Ho2 N2 O46.006 P4
• 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: 13.7501 ± 0.0004 Å
• b: 14.022 ± 0.0005 Å
• c: 23.1827 ± 0.0008 Å
• α: 100.079 ± 0.003°
• β: 100.637 ± 0.003°
• γ: 108.254 ± 0.003°
• Cell volume: 4040 ± 0.3 ų
• Cell temperature: 150.04 ± 0.13 K
• Ambient diffraction temperature: 150.04 ± 0.13 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: 0.0826
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for significantly intense reflections: 0.1858
• Weighted residual factors for all reflections included in the refinement: 0.2052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No