Information card for entry 4328849

Structure parameters

• Common name: Er
• Formula: C32 H72 Er1.33 N4 O14.67 P2.67
• Calculated formula: C32 H72 Er1.33333 N4 O14.6667 P2.66667
• Title of publication: Complexes of Lanthanide Nitrates with Tri Tert Butylphosphine Oxide
• Authors of publication: Allen Bowden; Simon J. Coles; Mateusz B. Pitak; Andrew W. G. Platt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4379 - 4389
• a: 28.2812 ± 0.0004 Å
• b: 28.2812 ± 0.0004 Å
• c: 15.0594 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 10431.2 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0566
• Weighted residual factors for all reflections included in the refinement: 0.0587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No